N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide

C13H10ClFN2O — CID 79770805

IUPACN-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(Cl)cn2)c(F)c1
InChIInChI=1S/C13H10ClFN2O/c1-8-2-4-10(11(15)6-8)13(18)17-12-5-3-9(14)7-16-12/h2-7H,1H3,(H,16,17,18)
InChIKeyOYABYJSIIRXQNW-UHFFFAOYSA-N
MW264.69 g/mol
LogP3.43
Rot. Bonds2

About N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide

N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide (PubChem CID 79770805) has the molecular formula C13H10ClFN2O and a molecular weight of 264.69 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide
PubChem CID79770805
Molecular FormulaC13H10ClFN2O
Molecular Weight264.69 g/mol
Exact Mass264.05
IUPAC NameN-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(Cl)cn2)c(F)c1
InChIInChI=1S/C13H10ClFN2O/c1-8-2-4-10(11(15)6-8)13(18)17-12-5-3-9(14)7-16-12/h2-7H,1H3,(H,16,17,18)
InChIKeyOYABYJSIIRXQNW-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

4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide
CID 26028133
N-(5-chloro-2-pyridinyl)-2-hydroxy-5-methylbenzamide
CID 28831587
N-(5-bromo-2-pyridinyl)-2-fluoro-4-methylbenzamide
CID 79770718
N-(4-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide
CID 115678914
N-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide
CID 112702466
N-(5-chloro-2-pyridinyl)-2-(ethylamino)-5-methylbenzamide
CID 62508806
N-[2-[(5-chloro-2-pyridinyl)carbamoyl]-4-methylphenyl]-4-methyl-2-(methylcarbamoylamino)benzamide
CID 142786847
N-(5-chloro-2-fluorophenyl)-2-fluoro-4-methylbenzamide
CID 79770803
N-(5-chloro-2-pyridinyl)-2-fluorobenzamide;hydrochloride
CID 163325720
2-amino-N-(5-chloro-2-pyridinyl)-3-hydroxy-5-methylbenzamide
CID 153409482
4,5-dichloro-1-N,2-N-bis(5-chloro-2-pyridinyl)benzene-1,2-dicarboxamide
CID 3421055
2-amino-N-(5-chloro-2-pyridinyl)-4,5-difluorobenzamide
CID 21072646

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide (CID 79770805) is N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide is Cc1ccc(C(=O)Nc2ccc(Cl)cn2)c(F)c1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide?
The InChIKey is OYABYJSIIRXQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClFN2O/c1-8-2-4-10(11(15)6-8)13(18)17-12-5-3-9(14)7-16-12/h2-7H,1H3,(H,16,17,18).
What are the key properties of N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide?
N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide 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 N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide is sourced from PubChem (CID 79770805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).