N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide

C16H13FN4O2 — CID 86801923

IUPACN-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide
SMILESCn1cnc(-c2ccc(F)cc2)c1NC(=O)c1ncccc1O
InChIInChI=1S/C16H13FN4O2/c1-21-9-19-13(10-4-6-11(17)7-5-10)15(21)20-16(23)14-12(22)3-2-8-18-14/h2-9,22H,1H3,(H,20,23)
InChIKeyPPRKJPZQEARADG-UHFFFAOYSA-N
MW312.30 g/mol
LogP2.58
Rot. Bonds3

About N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide

N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide (PubChem CID 86801923) has the molecular formula C16H13FN4O2 and a molecular weight of 312.30 g/mol. Its IUPAC name is N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide
PubChem CID86801923
Molecular FormulaC16H13FN4O2
Molecular Weight312.30 g/mol
Exact Mass312.10
IUPAC NameN-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide
SMILESCn1cnc(-c2ccc(F)cc2)c1NC(=O)c1ncccc1O
InChIInChI=1S/C16H13FN4O2/c1-21-9-19-13(10-4-6-11(17)7-5-10)15(21)20-16(23)14-12(22)3-2-8-18-14/h2-9,22H,1H3,(H,20,23)
InChIKeyPPRKJPZQEARADG-UHFFFAOYSA-N
XLogP2.58
TPSA80.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.30
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 5-[[5-(4-fluorophenyl)-3-methylimidazol-4-yl]carbamoyl]furan-3-carboxylate
CID 75506103
2-(4-fluorophenyl)pyridin-3-ol
CID 22724568
N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-thiophen-2-ylprop-2-enamide
CID 91942855
N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-2-(1-hydroxycyclopentyl)acetamide
CID 111537507
2,2-difluoro-N-(3-methyl-5-phenylimidazol-4-yl)-2-(3-methyl-2-pyridinyl)acetamide
CID 100689114
N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide
CID 86817229
N-(2-bromo-5-fluorophenyl)-3-methylpyridine-2-carboxamide
CID 103753363
N-(2,5-dibromophenyl)-3-hydroxypyridine-2-carboxamide
CID 54955142
N-(2,5-difluoro-4-methylphenyl)-3-hydroxypyridine-2-carboxamide
CID 103586322
3-hydroxy-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 54860878
[5-(4-fluorophenyl)-3-methylimidazol-4-yl]methanol
CID 10560192
N-(5-bromo-2-fluorophenyl)-3-hydroxypyridine-2-carboxamide
CID 54861387

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide?
The IUPAC name of N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide (CID 86801923) is N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide.
What is the SMILES notation for N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide?
The canonical SMILES for N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide is Cn1cnc(-c2ccc(F)cc2)c1NC(=O)c1ncccc1O.
What is the InChIKey of N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide?
The InChIKey is PPRKJPZQEARADG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN4O2/c1-21-9-19-13(10-4-6-11(17)7-5-10)15(21)20-16(23)14-12(22)3-2-8-18-14/h2-9,22H,1H3,(H,20,23).
What are the key properties of N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide?
N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide has a molecular weight of 312.30 g/mol, XLogP of 2.58, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-fluorophenyl)-3-methylimidazol-4-yl]-3-hydroxypyridine-2-carboxamide is sourced from PubChem (CID 86801923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).