6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide

C14H12N6O — CID 119048406

IUPAC6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2ccc(-n3cncn3)cn2)n1
InChIInChI=1S/C14H12N6O/c1-10-3-2-4-12(18-10)14(21)19-13-6-5-11(7-16-13)20-9-15-8-17-20/h2-9H,1H3,(H,16,19,21)
InChIKeyVKWRHPMSRDLAJG-UHFFFAOYSA-N
MW280.29 g/mol
LogP1.62
Rot. Bonds3

About 6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide

6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide (PubChem CID 119048406) has the molecular formula C14H12N6O and a molecular weight of 280.29 g/mol. Its IUPAC name is 6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide
PubChem CID119048406
Molecular FormulaC14H12N6O
Molecular Weight280.29 g/mol
Exact Mass280.11
IUPAC Name6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2ccc(-n3cncn3)cn2)n1
InChIInChI=1S/C14H12N6O/c1-10-3-2-4-12(18-10)14(21)19-13-6-5-11(7-16-13)20-9-15-8-17-20/h2-9H,1H3,(H,16,19,21)
InChIKeyVKWRHPMSRDLAJG-UHFFFAOYSA-N
XLogP1.62
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.29
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,4-dimethyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyrimidine-5-carboxamide
CID 119048415
3-(propan-2-ylsulfamoyl)-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]benzamide
CID 167885767
N-(5-chloropyrazin-2-yl)-6-methylpyridine-2-carboxamide
CID 104964202
6-methyl-N-(1-pyridin-4-ylpyrazol-4-yl)pyridine-2-carboxamide
CID 110472224
2-N,6-N-bis(5-chloro-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 3421113
N,N-dimethyl-3-[[[5-(1,2,4-triazol-1-yl)-2-pyridinyl]amino]methyl]benzamide
CID 167755430
N-(6-methoxypyrimidin-4-yl)-6-methylpyridine-2-carboxamide
CID 154805805
6-methyl-N-[3-(1,2,4-triazol-1-yl)propyl]pyridine-2-carboxamide
CID 51079304
methyl 6-[(5-methyl-2-pyridinyl)carbamoyl]pyridine-2-carboxylate
CID 47325772
6-methyl-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide
CID 38697211
ethane;6-methyl-N-(6-pyridin-3-yl-2-pyridinyl)pyridine-2-carboxamide
CID 143094222
[4-(1,2,4-triazol-1-yl)phenyl]carbamic acid
CID 66927702

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide?
The IUPAC name of 6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide (CID 119048406) is 6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide?
The canonical SMILES for 6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide is Cc1cccc(C(=O)Nc2ccc(-n3cncn3)cn2)n1.
What is the InChIKey of 6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide?
The InChIKey is VKWRHPMSRDLAJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N6O/c1-10-3-2-4-12(18-10)14(21)19-13-6-5-11(7-16-13)20-9-15-8-17-20/h2-9H,1H3,(H,16,19,21).
What are the key properties of 6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide?
6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide has a molecular weight of 280.29 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[5-(1,2,4-triazol-1-yl)-2-pyridinyl]pyridine-2-carboxamide is sourced from PubChem (CID 119048406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).