N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide

C23H27FN2O2 — CID 26899763

IUPACN,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide
SMILESCCN(CC)C(=O)c1ccc(NC(=O)C2(c3cccc(F)c3)CCCC2)cc1
InChIInChI=1S/C23H27FN2O2/c1-3-26(4-2)21(27)17-10-12-20(13-11-17)25-22(28)23(14-5-6-15-23)18-8-7-9-19(24)16-18/h7-13,16H,3-6,14-15H2,1-2H3,(H,25,28)
InChIKeyWLRKREOPBBKKNW-UHFFFAOYSA-N
MW382.48 g/mol
LogP4.76
Rot. Bonds6

About N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide

N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide (PubChem CID 26899763) has the molecular formula C23H27FN2O2 and a molecular weight of 382.48 g/mol. Its IUPAC name is N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide.

Molecular Properties

Compound NameN,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide
PubChem CID26899763
Molecular FormulaC23H27FN2O2
Molecular Weight382.48 g/mol
Exact Mass382.21
IUPAC NameN,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide
SMILESCCN(CC)C(=O)c1ccc(NC(=O)C2(c3cccc(F)c3)CCCC2)cc1
InChIInChI=1S/C23H27FN2O2/c1-3-26(4-2)21(27)17-10-12-20(13-11-17)25-22(28)23(14-5-6-15-23)18-8-7-9-19(24)16-18/h7-13,16H,3-6,14-15H2,1-2H3,(H,25,28)
InChIKeyWLRKREOPBBKKNW-UHFFFAOYSA-N
XLogP4.76
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.48
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]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,N-diethyl-4-[(1-phenylcyclobutanecarbonyl)amino]benzamide
CID 27445895
2-[[4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzoyl]amino]acetic acid
CID 45435122
N-butyl-N-ethyl-4-[(1-phenylcyclopentanecarbonyl)amino]benzamide
CID 2947985
N-(3-acetamidophenyl)-1-(3-fluorophenyl)cyclopentane-1-carboxamide
CID 26114516
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 1-(3-fluorophenyl)cyclopentane-1-carboxylate
CID 42980645
N-(3,4-dimethoxyphenyl)-1-(3-fluorophenyl)cyclopentane-1-carboxamide
CID 26364802
methyl 2-[[3-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzoyl]amino]acetate
CID 60556072
N-[3-(diethylsulfamoyl)-4-methylphenyl]-1-(3-fluorophenyl)cyclobutane-1-carboxamide
CID 52559295
1-(3-fluorophenyl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]cyclopentane-1-carboxamide
CID 55962305
[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl]-[2-(3-fluoroanilino)-2-oxoethyl]-methylazanium
CID 9250391
1-(3-fluorophenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)cyclopentane-1-carboxamide
CID 9453348
N,N-diethyl-4-[[2-(1-hydroxycyclopentyl)acetyl]amino]benzamide
CID 111432194

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide?
The IUPAC name of N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide (CID 26899763) is N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide.
What is the SMILES notation for N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide?
The canonical SMILES for N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide is CCN(CC)C(=O)c1ccc(NC(=O)C2(c3cccc(F)c3)CCCC2)cc1.
What is the InChIKey of N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide?
The InChIKey is WLRKREOPBBKKNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27FN2O2/c1-3-26(4-2)21(27)17-10-12-20(13-11-17)25-22(28)23(14-5-6-15-23)18-8-7-9-19(24)16-18/h7-13,16H,3-6,14-15H2,1-2H3,(H,25,28).
What are the key properties of N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide?
N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide has a molecular weight of 382.48 g/mol, XLogP of 4.76, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]benzamide is sourced from PubChem (CID 26899763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).