N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide

C11H11FN2O3 — CID 121349254

IUPACN-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide
SMILESO=C(NF)c1ccccc1NC1CCOC1=O
InChIInChI=1S/C11H11FN2O3/c12-14-10(15)7-3-1-2-4-8(7)13-9-5-6-17-11(9)16/h1-4,9,13H,5-6H2,(H,14,15)
InChIKeyGLMVNIMDMGPSBM-UHFFFAOYSA-N
MW238.22 g/mol
LogP1.03
Rot. Bonds3

About N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide

N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide (PubChem CID 121349254) has the molecular formula C11H11FN2O3 and a molecular weight of 238.22 g/mol. Its IUPAC name is N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide.

Molecular Properties

Compound NameN-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide
PubChem CID121349254
Molecular FormulaC11H11FN2O3
Molecular Weight238.22 g/mol
Exact Mass238.08
IUPAC NameN-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide
SMILESO=C(NF)c1ccccc1NC1CCOC1=O
InChIInChI=1S/C11H11FN2O3/c12-14-10(15)7-3-1-2-4-8(7)13-9-5-6-17-11(9)16/h1-4,9,13H,5-6H2,(H,14,15)
InChIKeyGLMVNIMDMGPSBM-UHFFFAOYSA-N
XLogP1.03
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.22
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-halo', 'substructure': 'N/A'}

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Related Compounds

Methyl n-(2-aminobenzoyl)glycinate
CID 273128
methyl (2S)-2-[(2-aminobenzoyl)amino]propanoate
CID 11984151
2-[(Morpholin-4-ylacetyl)amino]benzamide
CID 717339
Benzamide, 2-((2-hydroxyethyl)amino)-
CID 3086277
2-amino-N-(oxolan-2-ylmethyl)benzamide
CID 3135654
Methyl 2-({2-[(4-methylbenzoyl)amino]benzoyl}amino)butanoate
CID 4411175
Methyl 3-[(2-aminobenzoyl)amino]propanoate
CID 43219195
dimethyl (2S)-2-[[2-(2-acetamidophenyl)-2-oxoacetyl]amino]butanedioate
CID 101537371
methyl (2S)-2-[[2-(2-acetamidophenyl)-2-oxoacetyl]amino]-4-methylpentanoate
CID 122177418
5-Hex-1-ynyl-2-(oxolan-3-ylamino)benzamide
CID 166631876
N-(2-Aminobenzoyl)glycine
CID 3080562
Glycine, N-(2-((3-(trifluoromethyl)phenyl)amino)benzoyl)-, ethyl ester
CID 217011

Frequently Asked Questions

What is the IUPAC name of N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide?
The IUPAC name of N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide (CID 121349254) is N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide.
What is the SMILES notation for N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide?
The canonical SMILES for N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide is O=C(NF)c1ccccc1NC1CCOC1=O.
What is the InChIKey of N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide?
The InChIKey is GLMVNIMDMGPSBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O3/c12-14-10(15)7-3-1-2-4-8(7)13-9-5-6-17-11(9)16/h1-4,9,13H,5-6H2,(H,14,15).
What are the key properties of N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide?
N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide has a molecular weight of 238.22 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-fluoro-2-[(2-oxooxolan-3-yl)amino]benzamide is sourced from PubChem (CID 121349254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).