1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide

C15H18F2N2O2 — CID 79647458

IUPAC1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide
SMILESNC(=O)C1(NC2CC2)CCC(Oc2ccc(F)cc2F)C1
InChIInChI=1S/C15H18F2N2O2/c16-9-1-4-13(12(17)7-9)21-11-5-6-15(8-11,14(18)20)19-10-2-3-10/h1,4,7,10-11,19H,2-3,5-6,8H2,(H2,18,20)
InChIKeyZGSFITZJFXVOOV-UHFFFAOYSA-N
MW296.32 g/mol
LogP1.87
Rot. Bonds5

About 1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide

1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide (PubChem CID 79647458) has the molecular formula C15H18F2N2O2 and a molecular weight of 296.32 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide
PubChem CID79647458
Molecular FormulaC15H18F2N2O2
Molecular Weight296.32 g/mol
Exact Mass296.13
IUPAC Name1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide
SMILESNC(=O)C1(NC2CC2)CCC(Oc2ccc(F)cc2F)C1
InChIInChI=1S/C15H18F2N2O2/c16-9-1-4-13(12(17)7-9)21-11-5-6-15(8-11,14(18)20)19-10-2-3-10/h1,4,7,10-11,19H,2-3,5-6,8H2,(H2,18,20)
InChIKeyZGSFITZJFXVOOV-UHFFFAOYSA-N
XLogP1.87
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.32
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(cyclopropylamino)-3-(2,4-difluorophenoxy)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

1-(cyclopropylamino)-3-(2,3-difluorophenoxy)cyclopentane-1-carboxamide
CID 79644449
1-(cyclopropylamino)-3-(2-methoxyphenoxy)cyclopentane-1-carboxamide
CID 79647928
1-(cyclopropylamino)-3-(3,5-dimethylphenoxy)cyclopentane-1-carboxamide
CID 79647749
3-(2-fluoro-4-nitrophenoxy)-1-(methylamino)cyclopentane-1-carboxamide
CID 79646685
methyl 1-(cyclopropylamino)-3-(3-fluorophenoxy)cyclopentane-1-carboxylate
CID 79647932
3-(3,5-difluorophenoxy)-1-(ethylamino)cyclopentane-1-carboxamide
CID 79648862
1-(ethylamino)-3-(2-methoxyphenoxy)cyclopentane-1-carboxamide
CID 79649310
1-(ethylamino)-3-(2-fluorophenoxy)cyclopentane-1-carboxylic acid
CID 79649075
methyl 3-(2-fluorophenoxy)-1-(methylamino)cyclopentane-1-carboxylate
CID 79648683
1-(methylamino)-3-(2-nitrophenoxy)cyclopentane-1-carboxamide
CID 79649110
1-(cyclopropylamino)-3-(3-fluorophenoxy)cyclohexane-1-carboxylic acid
CID 79635234
3-(2,3-difluorophenoxy)-1-(methylamino)cyclohexane-1-carboxamide
CID 79637427

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide?
The IUPAC name of 1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide (CID 79647458) is 1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide is NC(=O)C1(NC2CC2)CCC(Oc2ccc(F)cc2F)C1.
What is the InChIKey of 1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide?
The InChIKey is ZGSFITZJFXVOOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F2N2O2/c16-9-1-4-13(12(17)7-9)21-11-5-6-15(8-11,14(18)20)19-10-2-3-10/h1,4,7,10-11,19H,2-3,5-6,8H2,(H2,18,20).
What are the key properties of 1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide?
1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide has a molecular weight of 296.32 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3-(2,4-difluorophenoxy)cyclopentane-1-carboxamide is sourced from PubChem (CID 79647458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).