N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide

C13H21F2NO2 — CID 114094525

IUPACN-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide
SMILESO=C(C1CCC(F)(F)C1)N(CCCO)C1CCC1
InChIInChI=1S/C13H21F2NO2/c14-13(15)6-5-10(9-13)12(18)16(7-2-8-17)11-3-1-4-11/h10-11,17H,1-9H2
InChIKeyWBMVFAZFJYMMQF-UHFFFAOYSA-N
MW261.31 g/mol
LogP2.19
Rot. Bonds5

About N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide

N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide (PubChem CID 114094525) has the molecular formula C13H21F2NO2 and a molecular weight of 261.31 g/mol. Its IUPAC name is N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide
PubChem CID114094525
Molecular FormulaC13H21F2NO2
Molecular Weight261.31 g/mol
Exact Mass261.15
IUPAC NameN-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide
SMILESO=C(C1CCC(F)(F)C1)N(CCCO)C1CCC1
InChIInChI=1S/C13H21F2NO2/c14-13(15)6-5-10(9-13)12(18)16(7-2-8-17)11-3-1-4-11/h10-11,17H,1-9H2
InChIKeyWBMVFAZFJYMMQF-UHFFFAOYSA-N
XLogP2.19
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.31
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)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

Related Compounds

4,4-difluoro-N-(3-hydroxypropyl)-N-propan-2-ylcyclohexane-1-carboxamide
CID 81932489
N-cyclobutyl-4,4-difluoro-N-(3-hydroxypropyl)cyclohexane-1-carboxamide
CID 102866148
N-cyclobutyl-N-(3-hydroxypropyl)-4-(trifluoromethyl)cyclohexane-1-carboxamide
CID 102866576
N-cyclobutyl-N-(3-hydroxypropyl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 102866902
N-cyclobutyl-N-(3-hydroxypropyl)-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 102867087
N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)cyclopentanecarboxamide
CID 103857544
2-cyclobutyl-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 103915400
2-cyclobutyl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide
CID 107482348
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)cyclopentanecarboxamide
CID 107482825
N-cyclobutyl-3,3-difluoro-N-(2-hydroxyethyl)cyclopentane-1-carboxamide
CID 114094514
(3,3-Difluorocyclopentyl)-[2-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 114189112
3,3-difluoro-N-(3-hydroxypropyl)-N-propan-2-ylcyclopentane-1-carboxamide
CID 114226419

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide?
The IUPAC name of N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide (CID 114094525) is N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide?
The canonical SMILES for N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide is O=C(C1CCC(F)(F)C1)N(CCCO)C1CCC1.
What is the InChIKey of N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide?
The InChIKey is WBMVFAZFJYMMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21F2NO2/c14-13(15)6-5-10(9-13)12(18)16(7-2-8-17)11-3-1-4-11/h10-11,17H,1-9H2.
What are the key properties of N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide?
N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide has a molecular weight of 261.31 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-3,3-difluoro-N-(3-hydroxypropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 114094525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).