2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide

C12H15FN2O2 — CID 9163327

IUPAC2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide
SMILESCCCNC(=O)CNC(=O)c1ccccc1F
InChIInChI=1S/C12H15FN2O2/c1-2-7-14-11(16)8-15-12(17)9-5-3-4-6-10(9)13/h3-6H,2,7-8H2,1H3,(H,14,16)(H,15,17)
InChIKeyCBKOIDYBABOBIQ-UHFFFAOYSA-N
MW238.26 g/mol
LogP1.08
Rot. Bonds5

About 2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide

2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide (PubChem CID 9163327) has the molecular formula C12H15FN2O2 and a molecular weight of 238.26 g/mol. Its IUPAC name is 2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide
PubChem CID9163327
Molecular FormulaC12H15FN2O2
Molecular Weight238.26 g/mol
Exact Mass238.11
IUPAC Name2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide
SMILESCCCNC(=O)CNC(=O)c1ccccc1F
InChIInChI=1S/C12H15FN2O2/c1-2-7-14-11(16)8-15-12(17)9-5-3-4-6-10(9)13/h3-6H,2,7-8H2,1H3,(H,14,16)(H,15,17)
InChIKeyCBKOIDYBABOBIQ-UHFFFAOYSA-N
XLogP1.08
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.26
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-[2-(diethylamino)ethylamino]-2-oxoethyl]-2-fluorobenzamide
CID 29369017
2-fluoro-N-[2-[[2-(methylamino)acetyl]amino]ethyl]benzamide
CID 119742065
2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide
CID 579782
2-fluoro-6-hydroxy-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 104916754
2-bromo-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 18162727
N-[2-[2-[di(propan-2-yl)amino]ethylamino]-2-oxoethyl]-2-fluorobenzamide
CID 18160814
2-fluoro-N-[2-oxo-2-(prop-2-ynylamino)ethyl]benzamide
CID 18110116
2-fluoro-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
CID 40623473
2-fluoro-N-[2-oxo-2-(3-phenylpropylamino)ethyl]benzamide
CID 2463726
2-fluoro-N-[2-[(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]benzamide
CID 65110344
2-fluoro-N-[2-[2-(2-methylprop-2-enoxy)ethylamino]-2-oxoethyl]benzamide
CID 115699827
2-fluoro-N-[2-oxo-2-(3-propan-2-yloxypropylamino)ethyl]benzamide
CID 40628904

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide?
The IUPAC name of 2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide (CID 9163327) is 2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide?
The canonical SMILES for 2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide is CCCNC(=O)CNC(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide?
The InChIKey is CBKOIDYBABOBIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O2/c1-2-7-14-11(16)8-15-12(17)9-5-3-4-6-10(9)13/h3-6H,2,7-8H2,1H3,(H,14,16)(H,15,17).
What are the key properties of 2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide?
2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide has a molecular weight of 238.26 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide is sourced from PubChem (CID 9163327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).