N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide

C19H20FNO — CID 2604336

IUPACN-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide
SMILESO=C(NCc1ccccc1)C1(c2cccc(F)c2)CCCC1
InChIInChI=1S/C19H20FNO/c20-17-10-6-9-16(13-17)19(11-4-5-12-19)18(22)21-14-15-7-2-1-3-8-15/h1-3,6-10,13H,4-5,11-12,14H2,(H,21,22)
InChIKeyVLLXMLIOFJJRER-UHFFFAOYSA-N
MW297.37 g/mol
LogP3.95
Rot. Bonds4

About N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide

N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide (PubChem CID 2604336) has the molecular formula C19H20FNO and a molecular weight of 297.37 g/mol. Its IUPAC name is N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide
PubChem CID2604336
Molecular FormulaC19H20FNO
Molecular Weight297.37 g/mol
Exact Mass297.15
IUPAC NameN-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide
SMILESO=C(NCc1ccccc1)C1(c2cccc(F)c2)CCCC1
InChIInChI=1S/C19H20FNO/c20-17-10-6-9-16(13-17)19(11-4-5-12-19)18(22)21-14-15-7-2-1-3-8-15/h1-3,6-10,13H,4-5,11-12,14H2,(H,21,22)
InChIKeyVLLXMLIOFJJRER-UHFFFAOYSA-N
XLogP3.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.37
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide?
The IUPAC name of N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide (CID 2604336) is N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide?
The canonical SMILES for N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide is O=C(NCc1ccccc1)C1(c2cccc(F)c2)CCCC1.
What is the InChIKey of N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide?
The InChIKey is VLLXMLIOFJJRER-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO/c20-17-10-6-9-16(13-17)19(11-4-5-12-19)18(22)21-14-15-7-2-1-3-8-15/h1-3,6-10,13H,4-5,11-12,14H2,(H,21,22).
What are the key properties of N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide?
N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide has a molecular weight of 297.37 g/mol, XLogP of 3.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-(3-fluorophenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 2604336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).