5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide

C7H5BrF2N2O2 — CID 130110697

IUPAC5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)c1cc(Br)c(C(F)F)[nH]c1=O
InChIInChI=1S/C7H5BrF2N2O2/c8-3-1-2(6(11)13)7(14)12-4(3)5(9)10/h1,5H,(H2,11,13)(H,12,14)
InChIKeyJYSGRCFAXPHBLN-UHFFFAOYSA-N
MW267.03 g/mol
LogP1.17
Rot. Bonds2

About 5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide

5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 130110697) has the molecular formula C7H5BrF2N2O2 and a molecular weight of 267.03 g/mol. Its IUPAC name is 5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID130110697
Molecular FormulaC7H5BrF2N2O2
Molecular Weight267.03 g/mol
Exact Mass265.95
IUPAC Name5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)c1cc(Br)c(C(F)F)[nH]c1=O
InChIInChI=1S/C7H5BrF2N2O2/c8-3-1-2(6(11)13)7(14)12-4(3)5(9)10/h1,5H,(H2,11,13)(H,12,14)
InChIKeyJYSGRCFAXPHBLN-UHFFFAOYSA-N
XLogP1.17
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.03
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-amino-3-bromo-6-(difluoromethyl)-1H-pyridin-2-one
CID 130101701
2-(difluoromethyl)-3-hydroxy-6-oxo-1H-pyridine-4-carboxamide
CID 118820480
6-(difluoromethyl)-5-methyl-2-oxo-1H-pyridine-3-carbonyl chloride
CID 118814881
4,5-dibromo-2-(difluoromethoxy)benzamide
CID 118851773
2-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxylic acid
CID 130100251
4-bromo-6-(difluoromethyl)pyridine-3-carboxamide
CID 118851035
6-(difluoromethyl)-5-fluoro-4-oxo-1H-pyridine-3-carboxamide
CID 118848607
5-amino-4-bromo-6-(difluoromethyl)-1H-pyridin-2-one
CID 130101695
2-(difluoromethyl)-6-iodo-4-oxo-1H-pyridine-3-carboxamide
CID 118826057
5-(2-bromoacetyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 88699652
2-oxo-1,5,6,7-tetrahydropyrrolo[3,4-b]pyridine-3-carboxamide;hydrochloride
CID 91623841
4-(difluoromethyl)-5-hydroxy-6-oxo-1H-pyridine-3-carboxamide
CID 130100336

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide (CID 130110697) is 5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide is NC(=O)c1cc(Br)c(C(F)F)[nH]c1=O.
What is the InChIKey of 5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is JYSGRCFAXPHBLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5BrF2N2O2/c8-3-1-2(6(11)13)7(14)12-4(3)5(9)10/h1,5H,(H2,11,13)(H,12,14).
What are the key properties of 5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 267.03 g/mol, XLogP of 1.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 130110697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).