N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide

C12H12FNO2 — CID 82114443

IUPACN-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide
SMILESO=C(CNC(=O)C1CC1)c1ccc(F)cc1
InChIInChI=1S/C12H12FNO2/c13-10-5-3-8(4-6-10)11(15)7-14-12(16)9-1-2-9/h3-6,9H,1-2,7H2,(H,14,16)
InChIKeyLNJLBDHYWGZKNC-UHFFFAOYSA-N
MW221.23 g/mol
LogP1.53
Rot. Bonds4

About N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide

N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide (PubChem CID 82114443) has the molecular formula C12H12FNO2 and a molecular weight of 221.23 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide
PubChem CID82114443
Molecular FormulaC12H12FNO2
Molecular Weight221.23 g/mol
Exact Mass221.09
IUPAC NameN-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide
SMILESO=C(CNC(=O)C1CC1)c1ccc(F)cc1
InChIInChI=1S/C12H12FNO2/c13-10-5-3-8(4-6-10)11(15)7-14-12(16)9-1-2-9/h3-6,9H,1-2,7H2,(H,14,16)
InChIKeyLNJLBDHYWGZKNC-UHFFFAOYSA-N
XLogP1.53
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.23
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide 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-(4-methoxyphenyl)-2-oxoethyl]cyclopropanecarboxamide
CID 94261270
N-[2-[4-(2-methylpropyl)phenyl]-2-oxoethyl]cyclopropanecarboxamide
CID 94272830
N-phenacylcyclohexanecarboxamide
CID 54070217
N-[2-(4-fluoro-3-methylphenyl)-2-oxoethyl]cyclopentanecarboxamide
CID 82122155
N-[2-(4-fluoro-3-methylphenyl)-2-oxoethyl]cyclohexanecarboxamide
CID 94285899
N-[(Z)-1-(4-fluorophenyl)ethylideneamino]cyclopropanecarboxamide
CID 6078923
N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide
CID 46103850
N-(4-fluorophenyl)cyclopropanecarboxamide
CID 532027
N-[(4-fluorophenyl)methyl]-4-(hydroxymethyl)cyclohexane-1-carboxamide
CID 115151196
1-N-[(4-fluorophenyl)methyl]-4-N-(pyridin-4-ylmethyl)cyclohexane-1,4-dicarboxamide
CID 109148415
1-[2-(4-fluorophenyl)-2-oxoethyl]-3-propan-2-ylurea
CID 110661716
4-ethyl-N-[(4-fluorophenyl)methyl]cyclohexane-1-carboxamide
CID 123258530

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide (CID 82114443) is N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide is O=C(CNC(=O)C1CC1)c1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide?
The InChIKey is LNJLBDHYWGZKNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12FNO2/c13-10-5-3-8(4-6-10)11(15)7-14-12(16)9-1-2-9/h3-6,9H,1-2,7H2,(H,14,16).
What are the key properties of N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide?
N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide has a molecular weight of 221.23 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)-2-oxoethyl]cyclopropanecarboxamide is sourced from PubChem (CID 82114443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).