4-fluoro-N-(2-methyl-3-pyridinyl)benzamide

C13H11FN2O — CID 79041653

IUPAC4-fluoro-N-(2-methyl-3-pyridinyl)benzamide
SMILESCc1ncccc1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C13H11FN2O/c1-9-12(3-2-8-15-9)16-13(17)10-4-6-11(14)7-5-10/h2-8H,1H3,(H,16,17)
InChIKeyMXUSDPDFKTXLFO-UHFFFAOYSA-N
MW230.24 g/mol
LogP2.78
Rot. Bonds2

About 4-fluoro-N-(2-methyl-3-pyridinyl)benzamide

4-fluoro-N-(2-methyl-3-pyridinyl)benzamide (PubChem CID 79041653) has the molecular formula C13H11FN2O and a molecular weight of 230.24 g/mol. Its IUPAC name is 4-fluoro-N-(2-methyl-3-pyridinyl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(2-methyl-3-pyridinyl)benzamide
PubChem CID79041653
Molecular FormulaC13H11FN2O
Molecular Weight230.24 g/mol
Exact Mass230.09
IUPAC Name4-fluoro-N-(2-methyl-3-pyridinyl)benzamide
SMILESCc1ncccc1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C13H11FN2O/c1-9-12(3-2-8-15-9)16-13(17)10-4-6-11(14)7-5-10/h2-8H,1H3,(H,16,17)
InChIKeyMXUSDPDFKTXLFO-UHFFFAOYSA-N
XLogP2.78
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.24
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide
CID 79043682
3-bromo-4-fluoro-N-(2-methyl-3-pyridinyl)benzamide
CID 103715047
3,5-diamino-N-(2-methyl-3-pyridinyl)benzamide
CID 79042253
4-fluoro-N-pyrimidin-2-ylbenzamide
CID 797393
4-bromo-3-hydroxy-N-(2-methyl-3-pyridinyl)benzamide
CID 103957362
(E)-3-(4-fluorophenyl)-N-(2-methyl-3-pyridinyl)prop-2-enamide
CID 75408108
2-fluoro-6-hydroxy-N-(2-methyl-3-pyridinyl)benzamide
CID 104917973
N-(2,3-dimethylphenyl)-4-fluorobenzamide
CID 795282
3-fluoro-4-(3-hydroxyprop-1-ynyl)-N-(2-methyl-3-pyridinyl)benzamide
CID 79042973
5-fluoro-N-(2-methyl-3-pyridinyl)-2-nitrobenzamide
CID 79041873
4-(ethylamino)-3-methyl-N-(2-methyl-3-pyridinyl)benzamide
CID 79043080
4-fluoro-N-(3-iodo-2-methylphenyl)benzamide
CID 113368778

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(2-methyl-3-pyridinyl)benzamide?
The IUPAC name of 4-fluoro-N-(2-methyl-3-pyridinyl)benzamide (CID 79041653) is 4-fluoro-N-(2-methyl-3-pyridinyl)benzamide.
What is the SMILES notation for 4-fluoro-N-(2-methyl-3-pyridinyl)benzamide?
The canonical SMILES for 4-fluoro-N-(2-methyl-3-pyridinyl)benzamide is Cc1ncccc1NC(=O)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-(2-methyl-3-pyridinyl)benzamide?
The InChIKey is MXUSDPDFKTXLFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O/c1-9-12(3-2-8-15-9)16-13(17)10-4-6-11(14)7-5-10/h2-8H,1H3,(H,16,17).
What are the key properties of 4-fluoro-N-(2-methyl-3-pyridinyl)benzamide?
4-fluoro-N-(2-methyl-3-pyridinyl)benzamide has a molecular weight of 230.24 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(2-methyl-3-pyridinyl)benzamide is sourced from PubChem (CID 79041653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).