4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide

C7H7F2N3O2 — CID 118800901

IUPAC4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)c1c(N)cc(C(F)F)[nH]c1=O
InChIInChI=1S/C7H7F2N3O2/c8-5(9)3-1-2(10)4(6(11)13)7(14)12-3/h1,5H,(H2,11,13)(H3,10,12,14)
InChIKeyCSTDXGRKKDUZDP-UHFFFAOYSA-N
MW203.15 g/mol
LogP-0.01
Rot. Bonds2

About 4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide

4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 118800901) has the molecular formula C7H7F2N3O2 and a molecular weight of 203.15 g/mol. Its IUPAC name is 4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID118800901
Molecular FormulaC7H7F2N3O2
Molecular Weight203.15 g/mol
Exact Mass203.05
IUPAC Name4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)c1c(N)cc(C(F)F)[nH]c1=O
InChIInChI=1S/C7H7F2N3O2/c8-5(9)3-1-2(10)4(6(11)13)7(14)12-3/h1,5H,(H2,11,13)(H3,10,12,14)
InChIKeyCSTDXGRKKDUZDP-UHFFFAOYSA-N
XLogP-0.01
TPSA101.97 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.15
LogP ≤ 5-0.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide (CID 118800901) is 4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide is NC(=O)c1c(N)cc(C(F)F)[nH]c1=O.
What is the InChIKey of 4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is CSTDXGRKKDUZDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F2N3O2/c8-5(9)3-1-2(10)4(6(11)13)7(14)12-3/h1,5H,(H2,11,13)(H3,10,12,14).
What are the key properties of 4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide?
4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 203.15 g/mol, XLogP of -0.01, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-(difluoromethyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 118800901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).