2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide

C14H10FN5O — CID 61294563

IUPAC2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide
SMILESO=C(Nc1ccccc1-n1ccnn1)c1ccnc(F)c1
InChIInChI=1S/C14H10FN5O/c15-13-9-10(5-6-16-13)14(21)18-11-3-1-2-4-12(11)20-8-7-17-19-20/h1-9H,(H,18,21)
InChIKeyBZDGZTNZFOZISE-UHFFFAOYSA-N
MW283.27 g/mol
LogP2.05
Rot. Bonds3

About 2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide

2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide (PubChem CID 61294563) has the molecular formula C14H10FN5O and a molecular weight of 283.27 g/mol. Its IUPAC name is 2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide
PubChem CID61294563
Molecular FormulaC14H10FN5O
Molecular Weight283.27 g/mol
Exact Mass283.09
IUPAC Name2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide
SMILESO=C(Nc1ccccc1-n1ccnn1)c1ccnc(F)c1
InChIInChI=1S/C14H10FN5O/c15-13-9-10(5-6-16-13)14(21)18-11-3-1-2-4-12(11)20-8-7-17-19-20/h1-9H,(H,18,21)
InChIKeyBZDGZTNZFOZISE-UHFFFAOYSA-N
XLogP2.05
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.27
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-[2-(triazol-1-yl)phenyl]pyridazine-4-carboxamide
CID 75448348
2-bromo-N-[2-(triazol-1-yl)phenyl]furan-3-carboxamide
CID 106853061
3-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide
CID 115645903
N-(2-ethylphenyl)-2-fluoropyridine-4-carboxamide
CID 61294713
N-(2-carbamoylphenyl)-2-fluoropyridine-4-carboxamide
CID 60565205
2-fluoro-N-[2-(hydroxymethyl)phenyl]pyridine-4-carboxamide
CID 61294571
3-(methylsulfinylmethyl)-N-[2-(triazol-1-yl)phenyl]benzamide
CID 75517599
3-amino-N-[2-(triazol-1-yl)phenyl]pyridine-2-carboxamide
CID 104741177
N-(4-chloro-2-pyrrol-1-ylphenyl)-2-fluoropyridine-4-carboxamide
CID 56535981
N-[2-(2-amino-2-oxoethyl)phenyl]-2-fluoropyridine-4-carboxamide
CID 61295295
2,2,3,3-tetrafluoro-N-[2-(triazol-1-yl)phenyl]propanamide
CID 103737699
2-fluoro-N-(4-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 55203428

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide?
The IUPAC name of 2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide (CID 61294563) is 2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide?
The canonical SMILES for 2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide is O=C(Nc1ccccc1-n1ccnn1)c1ccnc(F)c1.
What is the InChIKey of 2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide?
The InChIKey is BZDGZTNZFOZISE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN5O/c15-13-9-10(5-6-16-13)14(21)18-11-3-1-2-4-12(11)20-8-7-17-19-20/h1-9H,(H,18,21).
What are the key properties of 2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide?
2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide has a molecular weight of 283.27 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[2-(triazol-1-yl)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 61294563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).