6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide

C18H18N6O — CID 70711892

IUPAC6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1ccc2nc(C(=O)NCCCc3nnc4ccccn34)cn2c1
InChIInChI=1S/C18H18N6O/c1-13-7-8-15-20-14(12-23(15)11-13)18(25)19-9-4-6-17-22-21-16-5-2-3-10-24(16)17/h2-3,5,7-8,10-12H,4,6,9H2,1H3,(H,19,25)
InChIKeySVVCVEFWNCYJSD-UHFFFAOYSA-N
MW334.38 g/mol
LogP2.05
Rot. Bonds5

About 6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide

6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 70711892) has the molecular formula C18H18N6O and a molecular weight of 334.38 g/mol. Its IUPAC name is 6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID70711892
Molecular FormulaC18H18N6O
Molecular Weight334.38 g/mol
Exact Mass334.15
IUPAC Name6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1ccc2nc(C(=O)NCCCc3nnc4ccccn34)cn2c1
InChIInChI=1S/C18H18N6O/c1-13-7-8-15-20-14(12-23(15)11-13)18(25)19-9-4-6-17-22-21-16-5-2-3-10-24(16)17/h2-3,5,7-8,10-12H,4,6,9H2,1H3,(H,19,25)
InChIKeySVVCVEFWNCYJSD-UHFFFAOYSA-N
XLogP2.05
TPSA76.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-propyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-1,3-thiazole-4-carboxamide
CID 118782263
5-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]thiophene-2-carboxamide
CID 91947820
2,5-dimethyl-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide
CID 24535728
2,6-dichloro-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]benzamide
CID 91947806
1-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]indole-6-carboxamide
CID 71702523
N-(2-acetamidoethyl)-6-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 77092893
3-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-1-benzofuran-2-carboxamide
CID 91947627
5-(4-methoxyphenyl)-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-1,2-oxazole-3-carboxamide
CID 91947614
N-[2-(dimethylamino)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 87051424
5-bromo-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]furan-2-carboxamide
CID 91947819
5-methoxy-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]furan-2-carboxamide
CID 91793630
3,4,5-trimethoxy-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]benzamide
CID 45496104

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide (CID 70711892) is 6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide is Cc1ccc2nc(C(=O)NCCCc3nnc4ccccn34)cn2c1.
What is the InChIKey of 6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is SVVCVEFWNCYJSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6O/c1-13-7-8-15-20-14(12-23(15)11-13)18(25)19-9-4-6-17-22-21-16-5-2-3-10-24(16)17/h2-3,5,7-8,10-12H,4,6,9H2,1H3,(H,19,25).
What are the key properties of 6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide?
6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 70711892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).