N-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide

C13H10BrFN2O2 — CID 103753597

IUPACN-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)Nc1cc(F)ccc1Br
InChIInChI=1S/C13H10BrFN2O2/c1-19-13-9(3-2-6-16-13)12(18)17-11-7-8(15)4-5-10(11)14/h2-7H,1H3,(H,17,18)
InChIKeyMBQWRKILFVTDOM-UHFFFAOYSA-N
MW325.14 g/mol
LogP3.24
Rot. Bonds3

About N-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide

N-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide (PubChem CID 103753597) has the molecular formula C13H10BrFN2O2 and a molecular weight of 325.14 g/mol. Its IUPAC name is N-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide
PubChem CID103753597
Molecular FormulaC13H10BrFN2O2
Molecular Weight325.14 g/mol
Exact Mass323.99
IUPAC NameN-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)Nc1cc(F)ccc1Br
InChIInChI=1S/C13H10BrFN2O2/c1-19-13-9(3-2-6-16-13)12(18)17-11-7-8(15)4-5-10(11)14/h2-7H,1H3,(H,17,18)
InChIKeyMBQWRKILFVTDOM-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-(2-bromo-5-methylphenyl)-2-methoxypyridine-3-carboxamide
CID 82707201
N-(2,4-difluorophenyl)-2-methoxypyridine-3-carboxamide
CID 2819487
N-(2-bromophenyl)-2-methoxypyridine-3-carboxamide
CID 55023834
N-(2-bromo-5-fluorophenyl)-2-methylpyridine-3-carboxamide
CID 103753400
N-(2-bromo-5-fluorophenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 107631593
N-[4-fluoro-2-(methylsulfonylmethyl)phenyl]-2-methoxypyridine-3-carboxamide
CID 136514815
N-(3-fluoro-2-iodophenyl)-2-methoxypyridine-3-carboxamide
CID 113340929
3-fluoro-N-(2-methoxy-3-pyridinyl)benzamide
CID 47038518
N-(2-bromo-5-fluorophenyl)-3-methylpyridine-2-carboxamide
CID 103753363
N-(2-bromo-4-carbamothioylphenyl)-2-methoxypyridine-3-carboxamide
CID 107789815
2-bromo-N-(5-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 113255067
N-(4-bromo-2-carbamothioylphenyl)-2-methoxypyridine-3-carboxamide
CID 82695069

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide?
The IUPAC name of N-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide (CID 103753597) is N-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide?
The canonical SMILES for N-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide is COc1ncccc1C(=O)Nc1cc(F)ccc1Br.
What is the InChIKey of N-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide?
The InChIKey is MBQWRKILFVTDOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrFN2O2/c1-19-13-9(3-2-6-16-13)12(18)17-11-7-8(15)4-5-10(11)14/h2-7H,1H3,(H,17,18).
What are the key properties of N-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide?
N-(2-bromo-5-fluorophenyl)-2-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-(2-bromo-5-fluorophenyl)-2-methoxypyridine-3-carboxamide is sourced from PubChem (CID 103753597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).