33089-74-6
C₁₀H₁₄N₂·162.230 g/mol·CID 36326
IUPAC: N-(2,4-dimethylphenyl)-N'-methylmethanimidamide
Also known as: N'-(2,4-Dimethylphenyl)-N-methylformamidine, Semiamitraz, Methanimidamide, N-(2,4-dimethylphenyl)-N'-methyl-, N'-(2,4-Xylyl)-N-methylformamidine, DTXSID1037696 (+14 more)
Molecular Structure
Molecular Propertiesmass · H-bonds · stereo
Molecular Weight
162.230g/mol
Exact Mass
162.115698Da
Monoisotopic Mass
162.115698Da
XLogP
1.7
Polar Surface Area
24.4Ų
Complexity
154
Formal Charge
0
H-Bond Donors
1
H-Bond Acceptors
1
Rotatable Bonds
2
Heavy Atoms
12
Stereo Centers
0
Bond Stereo
0
Drug-Likeness (Lipinski's Rule of Five)
✓ 162.2 g/mol
MW ≤ 500
✓ 1.7
LogP ≤ 5
✓ 1
H-bond donors ≤ 5
✓ 1
H-bond acceptors ≤ 10
Passes all rules — good oral bioavailability predicted
Chemical IdentifiersSMILES · InChI
InChI
InChI=1S/C10H14N2/c1-8-4-5-10(9(2)6-8)12-7-11-3/h4-7H,1-3H3,(H,11,12)
Isomers8 compounds with formula C₁₀H₁₄N₂
3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 89594 · 162.2 g/mol
3-[(2S)-piperidin-2-yl]pyridine
CID 205586 · 162.2 g/mol
3-(1-methylpyrrolidin-2-yl)pyridine
CID 942 · 162.2 g/mol
3-piperidin-2-ylpyridine
CID 2181 · 162.2 g/mol
(E)-N-methyl-4-pyridin-3-ylbut-3-en-1-amine
CID 5310967 · 162.2 g/mol
1-phenylpiperazine
CID 7096 · 162.2 g/mol
3-[(2R)-1-methylpyrrolidin-2-yl]pyridine
CID 157672 · 162.2 g/mol
3-[(2R)-piperidin-2-yl]pyridine
CID 641266 · 162.2 g/mol