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

C13H10ClFN2O — CID 112702466

IUPACN-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide
SMILESCc1cc(F)ccc1C(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C13H10ClFN2O/c1-8-6-10(15)3-4-11(8)13(18)17-12-5-2-9(14)7-16-12/h2-7H,1H3,(H,16,17,18)
InChIKeyOPFPNPOGEULQQA-UHFFFAOYSA-N
MW264.69 g/mol
LogP3.43
Rot. Bonds2

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

N-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide (PubChem CID 112702466) has the molecular formula C13H10ClFN2O and a molecular weight of 264.69 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide
PubChem CID112702466
Molecular FormulaC13H10ClFN2O
Molecular Weight264.69 g/mol
Exact Mass264.05
IUPAC NameN-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide
SMILESCc1cc(F)ccc1C(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C13H10ClFN2O/c1-8-6-10(15)3-4-11(8)13(18)17-12-5-2-9(14)7-16-12/h2-7H,1H3,(H,16,17,18)
InChIKeyOPFPNPOGEULQQA-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-(5-chloro-2-pyridinyl)-6-fluoro-2-methylquinoline-3-carboxamide
CID 4732180
N-(5-chloro-2-pyridinyl)-2-methylbenzamide
CID 758009
4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide
CID 26028133
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
N-[2-[(5-chloro-2-pyridinyl)carbamoyl]-4-fluorophenyl]-5-fluoropyrimidine-2-carboxamide
CID 21072666
2-amino-4-fluoro-N-(5-methyl-2-pyridinyl)benzamide
CID 112687750
N-[5-chloro-2-(dimethylamino)phenyl]-4-fluoro-2-methylbenzamide
CID 115745652
4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide
CID 81225634
4-fluoro-2-methyl-N-pyrimidin-2-ylbenzamide
CID 115745693
N-(5-chloro-2-pyridinyl)-2-fluorobenzamide;hydrochloride
CID 163325720

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide (CID 112702466) is N-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide is Cc1cc(F)ccc1C(=O)Nc1ccc(Cl)cn1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide?
The InChIKey is OPFPNPOGEULQQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClFN2O/c1-8-6-10(15)3-4-11(8)13(18)17-12-5-2-9(14)7-16-12/h2-7H,1H3,(H,16,17,18).
What are the key properties of N-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide?
N-(5-chloro-2-pyridinyl)-4-fluoro-2-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)-4-fluoro-2-methylbenzamide is sourced from PubChem (CID 112702466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).