N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide

C15H15FN2O3 — CID 122145854

IUPACN-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide
SMILESO=C(NC(CO)Cc1ccc(F)cc1)c1ncccc1O
InChIInChI=1S/C15H15FN2O3/c16-11-5-3-10(4-6-11)8-12(9-19)18-15(21)14-13(20)2-1-7-17-14/h1-7,12,19-20H,8-9H2,(H,18,21)
InChIKeyBKUAEWDSGLQBDK-UHFFFAOYSA-N
MW290.29 g/mol
LogP1.26
Rot. Bonds5

About N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide

N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide (PubChem CID 122145854) has the molecular formula C15H15FN2O3 and a molecular weight of 290.29 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide
PubChem CID122145854
Molecular FormulaC15H15FN2O3
Molecular Weight290.29 g/mol
Exact Mass290.11
IUPAC NameN-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide
SMILESO=C(NC(CO)Cc1ccc(F)cc1)c1ncccc1O
InChIInChI=1S/C15H15FN2O3/c16-11-5-3-10(4-6-11)8-12(9-19)18-15(21)14-13(20)2-1-7-17-14/h1-7,12,19-20H,8-9H2,(H,18,21)
InChIKeyBKUAEWDSGLQBDK-UHFFFAOYSA-N
XLogP1.26
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 51.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide
CID 60923596
5-fluoro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]pyridine-2-carboxamide
CID 102673867
N-[(2S)-1-hydroxybutan-2-yl]-3-methylpyridine-2-carboxamide
CID 104981219
N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide
CID 55169382
5-fluoro-N-[(2S)-1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-2-methylbenzamide
CID 129358679
8-hydroxy-N-[1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]quinoline-7-carboxamide;methane
CID 158606160
(2S)-2-[(3-hydroxypyridine-2-carbonyl)amino]propanoic acid
CID 59513093
N-[(2S)-3-(4-fluorophenyl)-1-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]benzamide
CID 156695006
4-hydroxy-2-[(3-hydroxypyridine-2-carbonyl)amino]butanoic acid
CID 61243452
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]cyclohepta[c]pyrazole-3-carboxamide
CID 90910708
benzyl N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]carbamate
CID 85273603
2-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-3-carboxamide
CID 63008606

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide?
The IUPAC name of N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide (CID 122145854) is N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide?
The canonical SMILES for N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide is O=C(NC(CO)Cc1ccc(F)cc1)c1ncccc1O.
What is the InChIKey of N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide?
The InChIKey is BKUAEWDSGLQBDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O3/c16-11-5-3-10(4-6-11)8-12(9-19)18-15(21)14-13(20)2-1-7-17-14/h1-7,12,19-20H,8-9H2,(H,18,21).
What are the key properties of N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide?
N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide has a molecular weight of 290.29 g/mol, XLogP of 1.26, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide is sourced from PubChem (CID 122145854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).