5-bromo-2-methoxypyridine-3-carboxamide

C7H7BrN2O2 — CID 70281718

IUPAC5-bromo-2-methoxypyridine-3-carboxamide
SMILESCOc1ncc(Br)cc1C(N)=O
InChIInChI=1S/C7H7BrN2O2/c1-12-7-5(6(9)11)2-4(8)3-10-7/h2-3H,1H3,(H2,9,11)
InChIKeyIZZFUIWUXBBSRB-UHFFFAOYSA-N
MW231.05 g/mol
LogP0.95
Rot. Bonds2

About 5-bromo-2-methoxypyridine-3-carboxamide

5-bromo-2-methoxypyridine-3-carboxamide (PubChem CID 70281718) has the molecular formula C7H7BrN2O2 and a molecular weight of 231.05 g/mol. Its IUPAC name is 5-bromo-2-methoxypyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-2-methoxypyridine-3-carboxamide
PubChem CID70281718
Molecular FormulaC7H7BrN2O2
Molecular Weight231.05 g/mol
Exact Mass229.97
IUPAC Name5-bromo-2-methoxypyridine-3-carboxamide
SMILESCOc1ncc(Br)cc1C(N)=O
InChIInChI=1S/C7H7BrN2O2/c1-12-7-5(6(9)11)2-4(8)3-10-7/h2-3H,1H3,(H2,9,11)
InChIKeyIZZFUIWUXBBSRB-UHFFFAOYSA-N
XLogP0.95
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.05
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-5-methylpyridine-3-carboxamide
CID 123709075
5-bromo-2-methoxy-N-methylpyridine-3-carboxamide
CID 25114918
5-bromo-2-chloropyridine-3-carboxamide
CID 12629794
5-bromo-2-methylsulfanylpyridine-3-carboxamide
CID 145411187
5-bromo-2-(2,2-dimethoxyethyl)pyridine-3-carboxamide
CID 155895072
3-(5-bromo-2-methoxy-3-pyridinyl)-3-oxopropanenitrile;methyl 5-bromo-2-methoxypyridine-3-carboxylate
CID 158631727
S-(5-bromo-2-methoxy-3-pyridinyl)thiohydroxylamine
CID 126518732
3-[(5-bromo-3-methyl-2-pyridinyl)oxy]-5-methoxybenzamide
CID 103568126
3,5-dibromo-2-methoxybenzamide
CID 28665425
(Z)-3-(5-bromo-2-methoxy-3-pyridinyl)prop-2-enoic acid
CID 42553141
3-amino-6-bromo-2-methoxypyridine-4-carboxamide
CID 171566382
5-bromo-2-chloropyridine-3-carboxamide;5-bromo-2-chloropyridine-3-carboxylic acid
CID 167685517

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-methoxypyridine-3-carboxamide?
The IUPAC name of 5-bromo-2-methoxypyridine-3-carboxamide (CID 70281718) is 5-bromo-2-methoxypyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-2-methoxypyridine-3-carboxamide?
The canonical SMILES for 5-bromo-2-methoxypyridine-3-carboxamide is COc1ncc(Br)cc1C(N)=O.
What is the InChIKey of 5-bromo-2-methoxypyridine-3-carboxamide?
The InChIKey is IZZFUIWUXBBSRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrN2O2/c1-12-7-5(6(9)11)2-4(8)3-10-7/h2-3H,1H3,(H2,9,11).
What are the key properties of 5-bromo-2-methoxypyridine-3-carboxamide?
5-bromo-2-methoxypyridine-3-carboxamide has a molecular weight of 231.05 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-methoxypyridine-3-carboxamide is sourced from PubChem (CID 70281718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).