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

C10H11N7 — CID 114125340

IUPAC1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine
SMILESCn1cnc(Cn2c(N)nc3cnccc32)n1
InChIInChI=1S/C10H11N7/c1-16-6-13-9(15-16)5-17-8-2-3-12-4-7(8)14-10(17)11/h2-4,6H,5H2,1H3,(H2,11,14)
InChIKeyLNXLHAWBQXCVGW-UHFFFAOYSA-N
MW229.25 g/mol
LogP0.19
Rot. Bonds2

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

1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine (PubChem CID 114125340) has the molecular formula C10H11N7 and a molecular weight of 229.25 g/mol. Its IUPAC name is 1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine.

Molecular Properties

Compound Name1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine
PubChem CID114125340
Molecular FormulaC10H11N7
Molecular Weight229.25 g/mol
Exact Mass229.11
IUPAC Name1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine
SMILESCn1cnc(Cn2c(N)nc3cnccc32)n1
InChIInChI=1S/C10H11N7/c1-16-6-13-9(15-16)5-17-8-2-3-12-4-7(8)14-10(17)11/h2-4,6H,5H2,1H3,(H2,11,14)
InChIKeyLNXLHAWBQXCVGW-UHFFFAOYSA-N
XLogP0.19
TPSA87.44 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.25
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

7-chloro-1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine
CID 114286195
1-(3-methylsulfonylpropyl)imidazo[4,5-c]pyridin-2-amine
CID 79296529
1-(2-pyrrolidin-1-ylethyl)imidazo[4,5-c]pyridin-2-amine
CID 79296073
1-(3-imidazol-1-ylpropyl)imidazo[4,5-c]pyridin-2-amine
CID 79295607
1-[(4-propan-2-ylphenyl)methyl]imidazo[4,5-c]pyridin-2-amine
CID 79296071
1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-2-amine
CID 79295428
1-[(5-ethyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-c]pyridin-2-amine
CID 114128300
1-[(3-methyl-1,2-oxazol-5-yl)methyl]imidazo[4,5-c]pyridin-2-amine
CID 79295711
1-[2-(dimethylamino)-2-methylpropyl]imidazo[4,5-c]pyridin-2-amine
CID 79295803
7-methyl-3-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-amine
CID 114125339
1-(1,3-benzodioxol-5-ylmethyl)imidazo[4,5-c]pyridin-2-amine
CID 79271698
1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazo[4,5-c]pyridin-2-amine
CID 79296254

Frequently Asked Questions

What is the IUPAC name of 1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine?
The IUPAC name of 1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine (CID 114125340) is 1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine.
What is the SMILES notation for 1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine?
The canonical SMILES for 1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine is Cn1cnc(Cn2c(N)nc3cnccc32)n1.
What is the InChIKey of 1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine?
The InChIKey is LNXLHAWBQXCVGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N7/c1-16-6-13-9(15-16)5-17-8-2-3-12-4-7(8)14-10(17)11/h2-4,6H,5H2,1H3,(H2,11,14).
What are the key properties of 1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine?
1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine has a molecular weight of 229.25 g/mol, XLogP of 0.19, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-methyl-1,2,4-triazol-3-yl)methyl]imidazo[4,5-c]pyridin-2-amine is sourced from PubChem (CID 114125340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).