N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide

C13H10BrFN2O2 — CID 134017875

IUPACN-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)Nc2ccc(Br)cc2F)cn1
InChIInChI=1S/C13H10BrFN2O2/c1-19-12-5-2-8(7-16-12)13(18)17-11-4-3-9(14)6-10(11)15/h2-7H,1H3,(H,17,18)
InChIKeyCDGDFMVCJMWXRV-UHFFFAOYSA-N
MW325.14 g/mol
LogP3.24
Rot. Bonds3

About N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide

N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide (PubChem CID 134017875) has the molecular formula C13H10BrFN2O2 and a molecular weight of 325.14 g/mol. Its IUPAC name is N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide
PubChem CID134017875
Molecular FormulaC13H10BrFN2O2
Molecular Weight325.14 g/mol
Exact Mass323.99
IUPAC NameN-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)Nc2ccc(Br)cc2F)cn1
InChIInChI=1S/C13H10BrFN2O2/c1-19-12-5-2-8(7-16-12)13(18)17-11-4-3-9(14)6-10(11)15/h2-7H,1H3,(H,17,18)
InChIKeyCDGDFMVCJMWXRV-UHFFFAOYSA-N
XLogP3.24
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.14
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-2-chlorophenyl)-6-methoxypyridine-3-carboxamide
CID 134016007
6-methoxy-N-(2,3,4-trifluorophenyl)pyridine-3-carboxamide
CID 84581357
N-(4-bromo-2-fluorophenyl)pyridazine-4-carboxamide
CID 112702158
N-(4-bromo-2-fluorophenyl)-1H-pyrazole-4-carboxamide
CID 43532914
4-bromo-3-fluoro-N-(6-methoxy-3-pyridinyl)benzamide
CID 47421902
3-bromo-N-(4-bromo-2-fluorophenyl)-5-ethoxy-4-methoxybenzamide
CID 26363010
6-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 84580545
4-chloro-3-[(6-methoxypyridine-3-carbonyl)amino]benzoic acid
CID 43358856
N-[(4-bromo-2-fluorophenyl)carbamothioyl]-3,4-dimethoxybenzamide
CID 1259259
N-[2-fluoro-5-(tetrazol-1-yl)phenyl]-6-methoxypyridine-3-carboxamide
CID 51090541
2-amino-N-(4-bromo-2-fluorophenyl)pyridine-4-carboxamide
CID 62151121
4-(2-amino-2-oxoethoxy)-N-(4-bromo-2-fluorophenyl)benzamide
CID 78820007

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide?
The IUPAC name of N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide (CID 134017875) is N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide?
The canonical SMILES for N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide is COc1ccc(C(=O)Nc2ccc(Br)cc2F)cn1.
What is the InChIKey of N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide?
The InChIKey is CDGDFMVCJMWXRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrFN2O2/c1-19-12-5-2-8(7-16-12)13(18)17-11-4-3-9(14)6-10(11)15/h2-7H,1H3,(H,17,18).
What are the key properties of N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide?
N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide has a molecular weight of 325.14 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-fluorophenyl)-6-methoxypyridine-3-carboxamide is sourced from PubChem (CID 134017875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).