5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide

C9H11BrN2O2 — CID 129393792

IUPAC5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1[nH]c(=O)c(C(=O)N(C)C)cc1Br
InChIInChI=1S/C9H11BrN2O2/c1-5-7(10)4-6(8(13)11-5)9(14)12(2)3/h4H,1-3H3,(H,11,13)
InChIKeySQGIAFDYGHYYBX-UHFFFAOYSA-N
MW259.10 g/mol
LogP1.15
Rot. Bonds1

About 5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide

5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 129393792) has the molecular formula C9H11BrN2O2 and a molecular weight of 259.10 g/mol. Its IUPAC name is 5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID129393792
Molecular FormulaC9H11BrN2O2
Molecular Weight259.10 g/mol
Exact Mass258.00
IUPAC Name5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1[nH]c(=O)c(C(=O)N(C)C)cc1Br
InChIInChI=1S/C9H11BrN2O2/c1-5-7(10)4-6(8(13)11-5)9(14)12(2)3/h4H,1-3H3,(H,11,13)
InChIKeySQGIAFDYGHYYBX-UHFFFAOYSA-N
XLogP1.15
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.10
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide
CID 125490555
5-bromo-N-[2-(cyclopropylmethoxy)ethyl]-N,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
CID 75458341
5-bromo-N-(2-methoxyethyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 129393787
5-bromo-N-cyclopropyl-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 129393053
4-bromo-N,N,2,5-tetramethylbenzamide
CID 176915241
N,N-dimethyl-2-oxo-1H-quinoline-3-carboxamide
CID 14117619
5-bromo-2-fluoro-N,N,4-trimethylbenzamide
CID 146171178
5-bromo-6-methyl-2-oxo-N-prop-2-enoxy-1H-pyridine-3-carboxamide
CID 125491454
5-bromo-6-methyl-N-[(2S)-1-[(R)-methylsulfinyl]propan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 99697750
5-bromo-3-ethyl-6-methyl-1H-pyridin-2-one
CID 20779274
5-bromo-6-methyl-N-[(2R)-octan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 125490373
5-bromo-6-methyl-N-[2-(3-methyl-1,2,4-triazol-4-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 86801961

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide (CID 129393792) is 5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide is Cc1[nH]c(=O)c(C(=O)N(C)C)cc1Br.
What is the InChIKey of 5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is SQGIAFDYGHYYBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrN2O2/c1-5-7(10)4-6(8(13)11-5)9(14)12(2)3/h4H,1-3H3,(H,11,13).
What are the key properties of 5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide?
5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 259.10 g/mol, XLogP of 1.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N,N,6-trimethyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 129393792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).