[2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid

C14H11FN2O3 — CID 23110222

IUPAC[2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid
SMILESO=C(O)NC(C(=O)c1ccc(F)cc1)c1cccnc1
InChIInChI=1S/C14H11FN2O3/c15-11-5-3-9(4-6-11)13(18)12(17-14(19)20)10-2-1-7-16-8-10/h1-8,12,17H,(H,19,20)
InChIKeySNQVVAJUYMWNCC-UHFFFAOYSA-N
MW274.25 g/mol
LogP2.41
Rot. Bonds4

About [2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid

[2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid (PubChem CID 23110222) has the molecular formula C14H11FN2O3 and a molecular weight of 274.25 g/mol. Its IUPAC name is [2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid.

Molecular Properties

Compound Name[2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid
PubChem CID23110222
Molecular FormulaC14H11FN2O3
Molecular Weight274.25 g/mol
Exact Mass274.08
IUPAC Name[2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid
SMILESO=C(O)NC(C(=O)c1ccc(F)cc1)c1cccnc1
InChIInChI=1S/C14H11FN2O3/c15-11-5-3-9(4-6-11)13(18)12(17-14(19)20)10-2-1-7-16-8-10/h1-8,12,17H,(H,19,20)
InChIKeySNQVVAJUYMWNCC-UHFFFAOYSA-N
XLogP2.41
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.25
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-N-(1-pyridin-3-ylethyl)benzamide
CID 18162974
4-fluoro-N-[3-methyl-1-oxo-1-(1-pyridin-3-ylethylamino)butan-2-yl]benzamide
CID 18168796
(4-fluorophenyl)-pyridin-3-ylmethanone
CID 762660
2-bromo-1-(4-methylphenyl)-2-pyridin-3-ylethanone
CID 22282292
2-(propanoylamino)-2-pyridin-3-ylacetic acid
CID 82077606
3-(4-fluorophenyl)-1-pyridin-3-ylpropan-1-ol
CID 19775361
N-(4-fluorophenyl)-2-[[(1R)-1-pyridin-3-ylethyl]amino]acetamide
CID 81404886
2-(3-fluoro-5-methylanilino)-2-pyridin-3-ylacetamide
CID 79055306
(2R)-2-(cyclopropylamino)-2-pyridin-3-ylacetic acid
CID 93280695
1,4-bis(4-fluorophenyl)-2,3-diphenylbutane-1,4-dione
CID 70902431
N-[(2S)-2-(4-fluorophenyl)sulfonyl-2-pyridin-3-ylethyl]benzamide
CID 9155547
N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide
CID 75380343

Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid?
The IUPAC name of [2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid (CID 23110222) is [2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid.
What is the SMILES notation for [2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid?
The canonical SMILES for [2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid is O=C(O)NC(C(=O)c1ccc(F)cc1)c1cccnc1.
What is the InChIKey of [2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid?
The InChIKey is SNQVVAJUYMWNCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O3/c15-11-5-3-9(4-6-11)13(18)12(17-14(19)20)10-2-1-7-16-8-10/h1-8,12,17H,(H,19,20).
What are the key properties of [2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid?
[2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid has a molecular weight of 274.25 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorophenyl)-2-oxo-1-pyridin-3-ylethyl]carbamic acid is sourced from PubChem (CID 23110222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).