N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide

C10H7F3N4O2 — CID 63563115

IUPACN-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ncc[nH]1)c1ccc(C(F)(F)F)[nH]c1=O
InChIInChI=1S/C10H7F3N4O2/c11-10(12,13)6-2-1-5(7(18)16-6)8(19)17-9-14-3-4-15-9/h1-4H,(H,16,18)(H2,14,15,17,19)
InChIKeyBNOHBZSNIMEQAA-UHFFFAOYSA-N
MW272.19 g/mol
LogP1.37
Rot. Bonds2

About N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide

N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (PubChem CID 63563115) has the molecular formula C10H7F3N4O2 and a molecular weight of 272.19 g/mol. Its IUPAC name is N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
PubChem CID63563115
Molecular FormulaC10H7F3N4O2
Molecular Weight272.19 g/mol
Exact Mass272.05
IUPAC NameN-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ncc[nH]1)c1ccc(C(F)(F)F)[nH]c1=O
InChIInChI=1S/C10H7F3N4O2/c11-10(12,13)6-2-1-5(7(18)16-6)8(19)17-9-14-3-4-15-9/h1-4H,(H,16,18)(H2,14,15,17,19)
InChIKeyBNOHBZSNIMEQAA-UHFFFAOYSA-N
XLogP1.37
TPSA90.64 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.19
LogP ≤ 51.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide (CID 63563115) is N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is O=C(Nc1ncc[nH]1)c1ccc(C(F)(F)F)[nH]c1=O.
What is the InChIKey of N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
The InChIKey is BNOHBZSNIMEQAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F3N4O2/c11-10(12,13)6-2-1-5(7(18)16-6)8(19)17-9-14-3-4-15-9/h1-4H,(H,16,18)(H2,14,15,17,19).
What are the key properties of N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide?
N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide has a molecular weight of 272.19 g/mol, XLogP of 1.37, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-yl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 63563115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).