4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one

C10H11FN2O2 — CID 504020

IUPAC4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one
SMILESNC1CON(Cc2ccc(F)cc2)C1=O
InChIInChI=1S/C10H11FN2O2/c11-8-3-1-7(2-4-8)5-13-10(14)9(12)6-15-13/h1-4,9H,5-6,12H2
InChIKeyPGXHBINJZDOSIH-UHFFFAOYSA-N
MW210.21 g/mol
LogP0.43
Rot. Bonds2

About 4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one

4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one (PubChem CID 504020) has the molecular formula C10H11FN2O2 and a molecular weight of 210.21 g/mol. Its IUPAC name is 4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one.

Molecular Properties

Compound Name4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one
PubChem CID504020
Molecular FormulaC10H11FN2O2
Molecular Weight210.21 g/mol
Exact Mass210.08
IUPAC Name4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one
SMILESNC1CON(Cc2ccc(F)cc2)C1=O
InChIInChI=1S/C10H11FN2O2/c11-8-3-1-7(2-4-8)5-13-10(14)9(12)6-15-13/h1-4,9H,5-6,12H2
InChIKeyPGXHBINJZDOSIH-UHFFFAOYSA-N
XLogP0.43
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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N-Benzyl-L-serinamide
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Propanamide, 2-amino-3-methoxy-N-(phenylmethyl)-, (2S)-
CID 56666810
(2R)-2-acetamido-N-[(2-fluorophenyl)methyl]-3-methoxypropanamide
CID 45486446
4-Amino-2-benzyl-isoxazolidin-3-one
CID 504019
2-amino-N-benzyl-3-methoxypropanamide
CID 9837181
(2R)-2-acetamido-N-[(3-fluorophenyl)methyl]-3-methoxypropanamide
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(2R)-2-acetamido-N-[(4-fluorophenyl)methyl]-3-methoxypropanamide
CID 9943301

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one?
The IUPAC name of 4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one (CID 504020) is 4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one.
What is the SMILES notation for 4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one?
The canonical SMILES for 4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one is NC1CON(Cc2ccc(F)cc2)C1=O.
What is the InChIKey of 4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one?
The InChIKey is PGXHBINJZDOSIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2O2/c11-8-3-1-7(2-4-8)5-13-10(14)9(12)6-15-13/h1-4,9H,5-6,12H2.
What are the key properties of 4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one?
4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one has a molecular weight of 210.21 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-[(4-fluorophenyl)methyl]-1,2-oxazolidin-3-one is sourced from PubChem (CID 504020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).