N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide

C14H11N5O — CID 16764606

IUPACN-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(-n2cnnc2)nc1
InChIInChI=1S/C14H11N5O/c20-14(18-12-4-2-1-3-5-12)11-6-7-13(15-8-11)19-9-16-17-10-19/h1-10H,(H,18,20)
InChIKeyCYWGMBINXFNNNG-UHFFFAOYSA-N
MW265.28 g/mol
LogP1.91
Rot. Bonds3

About N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide

N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide (PubChem CID 16764606) has the molecular formula C14H11N5O and a molecular weight of 265.28 g/mol. Its IUPAC name is N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide
PubChem CID16764606
Molecular FormulaC14H11N5O
Molecular Weight265.28 g/mol
Exact Mass265.10
IUPAC NameN-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(-n2cnnc2)nc1
InChIInChI=1S/C14H11N5O/c20-14(18-12-4-2-1-3-5-12)11-6-7-13(15-8-11)19-9-16-17-10-19/h1-10H,(H,18,20)
InChIKeyCYWGMBINXFNNNG-UHFFFAOYSA-N
XLogP1.91
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-pyrrol-1-yl-N-[6-(1,2,4-triazol-4-yl)-3-pyridinyl]benzamide
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6-(4-benzylpiperazin-1-yl)-N-phenylpyridine-3-carboxamide
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N-[6-(1,2,4-triazol-4-yl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide
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6-methoxy-N-phenylpyridine-3-carboxamide
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6-methyl-N-[4-(phenylcarbamoylamino)phenyl]pyridine-3-carboxamide
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(4-phenylpiperazin-1-yl)-[6-(1,2,4-triazol-4-yl)-3-pyridinyl]methanone
CID 91952840
N-phenyl-6-pyridin-4-ylpyridine-3-carboxamide
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N-[4-(cyanomethyl)phenyl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 33427699
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N-phenyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide?
The IUPAC name of N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide (CID 16764606) is N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide?
The canonical SMILES for N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide is O=C(Nc1ccccc1)c1ccc(-n2cnnc2)nc1.
What is the InChIKey of N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide?
The InChIKey is CYWGMBINXFNNNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5O/c20-14(18-12-4-2-1-3-5-12)11-6-7-13(15-8-11)19-9-16-17-10-19/h1-10H,(H,18,20).
What are the key properties of N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide?
N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide has a molecular weight of 265.28 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide is sourced from PubChem (CID 16764606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).