3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide

C16H12N6O — CID 151275107

IUPAC3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide
SMILESNC(=O)c1ccc2nnn(Cc3ccc4ncccc4c3)c2n1
InChIInChI=1S/C16H12N6O/c17-15(23)13-5-6-14-16(19-13)22(21-20-14)9-10-3-4-12-11(8-10)2-1-7-18-12/h1-8H,9H2,(H2,17,23)
InChIKeyNXEPPJZDOBOJEH-UHFFFAOYSA-N
MW304.31 g/mol
LogP1.52
Rot. Bonds3

About 3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide

3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide (PubChem CID 151275107) has the molecular formula C16H12N6O and a molecular weight of 304.31 g/mol. Its IUPAC name is 3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide.

Molecular Properties

Compound Name3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide
PubChem CID151275107
Molecular FormulaC16H12N6O
Molecular Weight304.31 g/mol
Exact Mass304.11
IUPAC Name3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide
SMILESNC(=O)c1ccc2nnn(Cc3ccc4ncccc4c3)c2n1
InChIInChI=1S/C16H12N6O/c17-15(23)13-5-6-14-16(19-13)22(21-20-14)9-10-3-4-12-11(8-10)2-1-7-18-12/h1-8H,9H2,(H2,17,23)
InChIKeyNXEPPJZDOBOJEH-UHFFFAOYSA-N
XLogP1.52
TPSA99.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[[5-(5-methylthiophen-2-yl)triazolo[4,5-b]pyridin-3-yl]methyl]quinoline
CID 58514910
N-methyl-4-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridin-5-yl]benzamide
CID 54670238
6-[(5-thiophen-2-yltriazolo[4,5-b]pyridin-3-yl)methyl]quinoline
CID 54760085
6-[[5-(1H-pyrazol-5-yl)triazolo[4,5-b]pyridin-3-yl]methyl]quinoline
CID 53261938
2-chloro-4-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridin-5-yl]benzoic acid
CID 66994823
2-fluoro-4-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridin-5-yl]benzoate
CID 131740796
6-[[5-(3-fluorophenyl)triazolo[4,5-b]pyridin-3-yl]methyl]quinoline
CID 54670606
6-[[5-(2-chloro-4-pyridinyl)triazolo[4,5-b]pyridin-3-yl]methyl]quinoline
CID 58514686
1-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]ethylidenehydrazine
CID 78153634
1-[4-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridin-5-yl]pyrazol-1-yl]propan-2-one
CID 58514893
(3-hydroxypyrrolidin-1-yl)-[4-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridin-5-yl]phenyl]methanone
CID 66995253
6-[[5-(4-methylthiophen-2-yl)triazolo[4,5-b]pyridin-3-yl]methyl]quinoline
CID 58514864

Frequently Asked Questions

What is the IUPAC name of 3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide?
The IUPAC name of 3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide (CID 151275107) is 3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide.
What is the SMILES notation for 3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide?
The canonical SMILES for 3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide is NC(=O)c1ccc2nnn(Cc3ccc4ncccc4c3)c2n1.
What is the InChIKey of 3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide?
The InChIKey is NXEPPJZDOBOJEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N6O/c17-15(23)13-5-6-14-16(19-13)22(21-20-14)9-10-3-4-12-11(8-10)2-1-7-18-12/h1-8H,9H2,(H2,17,23).
What are the key properties of 3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide?
3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide has a molecular weight of 304.31 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridine-5-carboxamide is sourced from PubChem (CID 151275107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).