2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide

C13H10ClFN2O2 — CID 167914388

IUPAC2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide
SMILESCOc1cncc(NC(=O)c2cccc(F)c2Cl)c1
InChIInChI=1S/C13H10ClFN2O2/c1-19-9-5-8(6-16-7-9)17-13(18)10-3-2-4-11(15)12(10)14/h2-7H,1H3,(H,17,18)
InChIKeyFFIGUXDCGJSWSU-UHFFFAOYSA-N
MW280.69 g/mol
LogP3.13
Rot. Bonds3

About 2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide

2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide (PubChem CID 167914388) has the molecular formula C13H10ClFN2O2 and a molecular weight of 280.69 g/mol. Its IUPAC name is 2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide.

Molecular Properties

Compound Name2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide
PubChem CID167914388
Molecular FormulaC13H10ClFN2O2
Molecular Weight280.69 g/mol
Exact Mass280.04
IUPAC Name2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide
SMILESCOc1cncc(NC(=O)c2cccc(F)c2Cl)c1
InChIInChI=1S/C13H10ClFN2O2/c1-19-9-5-8(6-16-7-9)17-13(18)10-3-2-4-11(15)12(10)14/h2-7H,1H3,(H,17,18)
InChIKeyFFIGUXDCGJSWSU-UHFFFAOYSA-N
XLogP3.13
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.69
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-(3-methoxyphenyl)benzamide
CID 2292975
N-(3-amino-4-fluorophenyl)-2-chloro-3-fluorobenzamide
CID 81453774
3-chloro-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 66462058
2-chloro-N-(3-chloro-4-hydroxyphenyl)-3-fluorobenzamide
CID 79039798
2-chloro-3-fluoro-N-(5-propan-2-yl-1,2-oxazol-3-yl)benzamide
CID 118894429
2-chloro-N-(3-chlorophenyl)-3-methoxybenzamide
CID 45051393
2,3-dichloro-N-(4-methoxyphenyl)benzamide
CID 881810
N-(3-amino-4-chlorophenyl)-2-chloro-3-fluorobenzamide
CID 81454097
2-amino-3-fluoro-N-(5-fluoro-3-pyridinyl)benzamide
CID 114253904
N-(5-methoxy-3-pyridinyl)-2-methyl-5-[[3-(trifluoromethyl)benzoyl]amino]benzamide
CID 68845366
2-chloro-3-fluoro-N-[4-(hydroxymethyl)phenyl]benzamide
CID 81461664
2-chloro-N-(3-cyanophenyl)-3-fluorobenzamide
CID 79035948

Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide?
The IUPAC name of 2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide (CID 167914388) is 2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide.
What is the SMILES notation for 2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide?
The canonical SMILES for 2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide is COc1cncc(NC(=O)c2cccc(F)c2Cl)c1.
What is the InChIKey of 2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide?
The InChIKey is FFIGUXDCGJSWSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClFN2O2/c1-19-9-5-8(6-16-7-9)17-13(18)10-3-2-4-11(15)12(10)14/h2-7H,1H3,(H,17,18).
What are the key properties of 2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide?
2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide has a molecular weight of 280.69 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3-fluoro-N-(5-methoxy-3-pyridinyl)benzamide is sourced from PubChem (CID 167914388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).