1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine

C12H18N4 — CID 103385588

IUPAC1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine
SMILESCCC(C)CNc1nccc2c1ncn2C
InChIInChI=1S/C12H18N4/c1-4-9(2)7-14-12-11-10(5-6-13-12)16(3)8-15-11/h5-6,8-9H,4,7H2,1-3H3,(H,13,14)
InChIKeyVGDXZIMOEVRKMZ-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.43
Rot. Bonds4

About 1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine

1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine (PubChem CID 103385588) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine.

Molecular Properties

Compound Name1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine
PubChem CID103385588
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine
SMILESCCC(C)CNc1nccc2c1ncn2C
InChIInChI=1S/C12H18N4/c1-4-9(2)7-14-12-11-10(5-6-13-12)16(3)8-15-11/h5-6,8-9H,4,7H2,1-3H3,(H,13,14)
InChIKeyVGDXZIMOEVRKMZ-UHFFFAOYSA-N
XLogP2.43
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-N-(2-methyl-3-methylsulfanylpropyl)imidazo[4,5-c]pyridin-4-amine
CID 103385628
N-(3-methoxy-2-methylpropyl)-1-methylimidazo[4,5-c]pyridin-4-amine
CID 103385555
3-methyl-1-N-(1-methylimidazo[4,5-c]pyridin-4-yl)butane-1,2-diamine
CID 103386011
1-methyl-N-(2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine
CID 103385789
4,4-dimethyl-1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]pentan-2-ol
CID 107153207
2-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]-1-phenylethanol
CID 103385395
1-methyl-N-(3-methylsulfanylbutyl)imidazo[4,5-c]pyridin-4-amine
CID 103385824
1-methyl-N-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-4-amine
CID 103385548
1-methyl-N-(2-methylbutan-2-yl)imidazo[4,5-c]pyridin-4-amine
CID 103385802
1-methyl-N-(2,2,3,3-tetrafluoropropyl)imidazo[4,5-c]pyridin-4-amine
CID 114169666
N-benzyl-1-methylimidazo[4,5-c]pyridin-4-amine
CID 1400630
4-methyl-6-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]hexanoic acid
CID 103385090

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine?
The IUPAC name of 1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine (CID 103385588) is 1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine.
What is the SMILES notation for 1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine?
The canonical SMILES for 1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine is CCC(C)CNc1nccc2c1ncn2C.
What is the InChIKey of 1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine?
The InChIKey is VGDXZIMOEVRKMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-4-9(2)7-14-12-11-10(5-6-13-12)16(3)8-15-11/h5-6,8-9H,4,7H2,1-3H3,(H,13,14).
What are the key properties of 1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine?
1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine has a molecular weight of 218.30 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine is sourced from PubChem (CID 103385588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).