2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid

C14H13N5O2 — CID 103385145

IUPAC2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid
SMILESCn1cnc2c(NCc3cc(C(=O)O)ccn3)nccc21
InChIInChI=1S/C14H13N5O2/c1-19-8-18-12-11(19)3-5-16-13(12)17-7-10-6-9(14(20)21)2-4-15-10/h2-6,8H,7H2,1H3,(H,16,17)(H,20,21)
InChIKeyZLOQBCIWRYNMHQ-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.67
Rot. Bonds4

About 2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid

2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid (PubChem CID 103385145) has the molecular formula C14H13N5O2 and a molecular weight of 283.29 g/mol. Its IUPAC name is 2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid
PubChem CID103385145
Molecular FormulaC14H13N5O2
Molecular Weight283.29 g/mol
Exact Mass283.11
IUPAC Name2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid
SMILESCn1cnc2c(NCc3cc(C(=O)O)ccn3)nccc21
InChIInChI=1S/C14H13N5O2/c1-19-8-18-12-11(19)3-5-16-13(12)17-7-10-6-9(14(20)21)2-4-15-10/h2-6,8H,7H2,1H3,(H,16,17)(H,20,21)
InChIKeyZLOQBCIWRYNMHQ-UHFFFAOYSA-N
XLogP1.67
TPSA92.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid with MolForge

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Related Compounds

2-[[(2,4-dimethyl-3,5-dioxo-1,2,4-triazin-6-yl)amino]methyl]pyridine-4-carboxylic acid
CID 114324501
N-benzyl-1-methylimidazo[4,5-c]pyridin-4-amine
CID 1400630
2-[[(4-ethyl-3-oxopyrazin-2-yl)amino]methyl]pyridine-4-carboxylic acid
CID 114324547
2-[[[3-(trifluoromethyl)-2-pyridinyl]amino]methyl]pyridine-4-carboxylic acid
CID 114324570
2-[(furo[3,2-c]pyridin-4-ylamino)methyl]pyridine-4-carboxylic acid
CID 106534944
2-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]methyl]pyridine-4-carboxylic acid
CID 114324451
2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid
CID 103385259
N-[(4-fluoro-3,5-dimethylphenyl)methyl]-1-methylimidazo[4,5-c]pyridin-4-amine
CID 103385715
2-[[(3-methylimidazole-4-carbonyl)amino]methyl]pyridine-4-carboxylic acid
CID 103510660
1-methyl-N-(2-methyl-2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine
CID 103385442
4-methyl-6-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]hexanoic acid
CID 103385090
N-(2-chloroprop-2-enyl)-1-methylimidazo[4,5-c]pyridin-4-amine
CID 103385795

Frequently Asked Questions

What is the IUPAC name of 2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid?
The IUPAC name of 2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid (CID 103385145) is 2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid.
What is the SMILES notation for 2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid?
The canonical SMILES for 2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid is Cn1cnc2c(NCc3cc(C(=O)O)ccn3)nccc21.
What is the InChIKey of 2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid?
The InChIKey is ZLOQBCIWRYNMHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O2/c1-19-8-18-12-11(19)3-5-16-13(12)17-7-10-6-9(14(20)21)2-4-15-10/h2-6,8H,7H2,1H3,(H,16,17)(H,20,21).
What are the key properties of 2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid?
2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid has a molecular weight of 283.29 g/mol, XLogP of 1.67, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid is sourced from PubChem (CID 103385145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).