4-fluoro-5-phenylpyridine-3-carboxamide

C12H9FN2O — CID 91379207

IUPAC4-fluoro-5-phenylpyridine-3-carboxamide
SMILESNC(=O)c1cncc(-c2ccccc2)c1F
InChIInChI=1S/C12H9FN2O/c13-11-9(8-4-2-1-3-5-8)6-15-7-10(11)12(14)16/h1-7H,(H2,14,16)
InChIKeyCJIBUFUVRWSIRD-UHFFFAOYSA-N
MW216.22 g/mol
LogP1.99
Rot. Bonds2

About 4-fluoro-5-phenylpyridine-3-carboxamide

4-fluoro-5-phenylpyridine-3-carboxamide (PubChem CID 91379207) has the molecular formula C12H9FN2O and a molecular weight of 216.22 g/mol. Its IUPAC name is 4-fluoro-5-phenylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-fluoro-5-phenylpyridine-3-carboxamide
PubChem CID91379207
Molecular FormulaC12H9FN2O
Molecular Weight216.22 g/mol
Exact Mass216.07
IUPAC Name4-fluoro-5-phenylpyridine-3-carboxamide
SMILESNC(=O)c1cncc(-c2ccccc2)c1F
InChIInChI=1S/C12H9FN2O/c13-11-9(8-4-2-1-3-5-8)6-15-7-10(11)12(14)16/h1-7H,(H2,14,16)
InChIKeyCJIBUFUVRWSIRD-UHFFFAOYSA-N
XLogP1.99
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.22
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-phenylpyrimidine-5-carboxamide
CID 160993699
4-(4-phenyl-1H-pyrazol-5-yl)pyridine-3-carboxamide
CID 162372217
2-fluoro-5-methyl-4-phenylbenzamide
CID 171905692
2-(3-fluoro-5-phenyl-4-pyridinyl)acetic acid
CID 131870069
2-phenylbenzamide;2,2,2-trifluoroacetic acid
CID 67160180
benzoic acid;2-phenylbenzamide
CID 70205361
3-phenyl-2-sulfamoylbenzamide;hydrochloride
CID 141093499
2,5-dimethyl-4-phenylbenzamide
CID 174491618
3-fluoro-4-iodo-5-phenylpyridine
CID 131015376
4-chloro-5-fluoropyridine-3-carboxamide
CID 99981298
2-fluoro-4-methyl-3-pyridin-3-ylbenzamide
CID 155144897
4-phenylthieno[2,3-c]pyridine-2-carboxamide;propane
CID 91467405

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-5-phenylpyridine-3-carboxamide?
The IUPAC name of 4-fluoro-5-phenylpyridine-3-carboxamide (CID 91379207) is 4-fluoro-5-phenylpyridine-3-carboxamide.
What is the SMILES notation for 4-fluoro-5-phenylpyridine-3-carboxamide?
The canonical SMILES for 4-fluoro-5-phenylpyridine-3-carboxamide is NC(=O)c1cncc(-c2ccccc2)c1F.
What is the InChIKey of 4-fluoro-5-phenylpyridine-3-carboxamide?
The InChIKey is CJIBUFUVRWSIRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9FN2O/c13-11-9(8-4-2-1-3-5-8)6-15-7-10(11)12(14)16/h1-7H,(H2,14,16).
What are the key properties of 4-fluoro-5-phenylpyridine-3-carboxamide?
4-fluoro-5-phenylpyridine-3-carboxamide has a molecular weight of 216.22 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-5-phenylpyridine-3-carboxamide is sourced from PubChem (CID 91379207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).