4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide

C13H10ClFN2O — CID 26028133

IUPAC4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide
SMILESCc1ccc(NC(=O)c2ccc(Cl)cc2F)nc1
InChIInChI=1S/C13H10ClFN2O/c1-8-2-5-12(16-7-8)17-13(18)10-4-3-9(14)6-11(10)15/h2-7H,1H3,(H,16,17,18)
InChIKeySEDZRJXIKRIBLI-UHFFFAOYSA-N
MW264.69 g/mol
LogP3.43
Rot. Bonds2

About 4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide

4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide (PubChem CID 26028133) has the molecular formula C13H10ClFN2O and a molecular weight of 264.69 g/mol. Its IUPAC name is 4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide
PubChem CID26028133
Molecular FormulaC13H10ClFN2O
Molecular Weight264.69 g/mol
Exact Mass264.05
IUPAC Name4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide
SMILESCc1ccc(NC(=O)c2ccc(Cl)cc2F)nc1
InChIInChI=1S/C13H10ClFN2O/c1-8-2-5-12(16-7-8)17-13(18)10-4-3-9(14)6-11(10)15/h2-7H,1H3,(H,16,17,18)
InChIKeySEDZRJXIKRIBLI-UHFFFAOYSA-N
XLogP3.43
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.69
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide
CID 79770805
N-(4-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide
CID 115678914
N-(5-bromo-2-pyridinyl)-2-fluoro-4-methylbenzamide
CID 79770718
3,5-dichloro-N-(5-methyl-2-pyridinyl)benzamide
CID 5063171
2-amino-4-fluoro-N-(5-methyl-2-pyridinyl)benzamide
CID 112687750
N-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide
CID 112702466
[4,5-difluoro-2-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-hydroxyazanium
CID 142112043
N-(5-chloro-2-fluorophenyl)-2-fluoro-4-methylbenzamide
CID 79770803
N-(5-chloro-2-pyridinyl)-2-hydroxy-5-methylbenzamide
CID 28831587
N-(3-chloro-4-fluorophenyl)-N'-(5-methyl-2-pyridinyl)oxamide
CID 108530574
2-amino-5-chloro-3-hydroxy-N-(5-methyl-2-pyridinyl)benzamide
CID 67991287
2-(5-chloro-2-fluorophenyl)imino-7-hydroxy-N-(5-methyl-2-pyridinyl)chromene-3-carboxamide
CID 135990507

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide?
The IUPAC name of 4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide (CID 26028133) is 4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide is Cc1ccc(NC(=O)c2ccc(Cl)cc2F)nc1.
What is the InChIKey of 4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide?
The InChIKey is SEDZRJXIKRIBLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClFN2O/c1-8-2-5-12(16-7-8)17-13(18)10-4-3-9(14)6-11(10)15/h2-7H,1H3,(H,16,17,18).
What are the key properties of 4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide?
4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide has a molecular weight of 264.69 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 26028133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).