2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine

C12H18N4 — CID 114793308

IUPAC2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine
SMILESCCC(C)C(N)c1nc2ccncc2n1C
InChIInChI=1S/C12H18N4/c1-4-8(2)11(13)12-15-9-5-6-14-7-10(9)16(12)3/h5-8,11H,4,13H2,1-3H3
InChIKeyDCWDTUOQHAXJAR-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.01
Rot. Bonds3

About 2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine

2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine (PubChem CID 114793308) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine.

Molecular Properties

Compound Name2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine
PubChem CID114793308
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine
SMILESCCC(C)C(N)c1nc2ccncc2n1C
InChIInChI=1S/C12H18N4/c1-4-8(2)11(13)12-15-9-5-6-14-7-10(9)16(12)3/h5-8,11H,4,13H2,1-3H3
InChIKeyDCWDTUOQHAXJAR-UHFFFAOYSA-N
XLogP2.01
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine
CID 114793236
2-(3-methylimidazo[4,5-c]pyridin-2-yl)propan-1-amine
CID 83858107
(1R)-2-methyl-1-(1-methylimidazo[4,5-c]pyridin-2-yl)propan-1-amine
CID 97005114
(3-methylimidazo[4,5-c]pyridin-2-yl)-phenylmethanamine
CID 114793414
5-(3-methylimidazo[4,5-c]pyridin-2-yl)pentan-2-amine
CID 114793304
1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine
CID 63268373
2-methyl-1-(1-phenylbenzimidazol-2-yl)butan-1-amine
CID 43470482
N-ethyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)propan-2-amine
CID 114793263
1-(1-cyclopropylbenzimidazol-2-yl)-2-methylbutan-1-amine
CID 43142729
1-(5-bromo-1-propan-2-ylbenzimidazol-2-yl)-2-methylbutan-1-amine
CID 60783637
N-[2-(3-methylimidazo[4,5-c]pyridin-2-yl)ethyl]propan-2-amine
CID 114793422
(1R)-2-methyl-1-pyridin-4-ylbutan-1-amine;hydrochloride
CID 171200287

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine?
The IUPAC name of 2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine (CID 114793308) is 2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine.
What is the SMILES notation for 2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine?
The canonical SMILES for 2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine is CCC(C)C(N)c1nc2ccncc2n1C.
What is the InChIKey of 2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine?
The InChIKey is DCWDTUOQHAXJAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-4-8(2)11(13)12-15-9-5-6-14-7-10(9)16(12)3/h5-8,11H,4,13H2,1-3H3.
What are the key properties of 2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine?
2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine has a molecular weight of 218.30 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)butan-1-amine is sourced from PubChem (CID 114793308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).