4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine

C17H27N — CID 63526556

IUPAC4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine
SMILESCCNC(CCC1CCCC1)Cc1ccccc1
InChIInChI=1S/C17H27N/c1-2-18-17(13-12-15-8-6-7-9-15)14-16-10-4-3-5-11-16/h3-5,10-11,15,17-18H,2,6-9,12-14H2,1H3
InChIKeyURIFDQIVXVTZSD-UHFFFAOYSA-N
MW245.41 g/mol
LogP4.18
Rot. Bonds7

About 4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine

4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine (PubChem CID 63526556) has the molecular formula C17H27N and a molecular weight of 245.41 g/mol. Its IUPAC name is 4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine
PubChem CID63526556
Molecular FormulaC17H27N
Molecular Weight245.41 g/mol
Exact Mass245.21
IUPAC Name4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine
SMILESCCNC(CCC1CCCC1)Cc1ccccc1
InChIInChI=1S/C17H27N/c1-2-18-17(13-12-15-8-6-7-9-15)14-16-10-4-3-5-11-16/h3-5,10-11,15,17-18H,2,6-9,12-14H2,1H3
InChIKeyURIFDQIVXVTZSD-UHFFFAOYSA-N
XLogP4.18
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine 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-cyclohexyl-N-ethyl-3-phenylpropan-2-amine
CID 55188118
4-cyclopentyl-N-ethyl-1-(4-nitrophenyl)butan-2-amine
CID 61065009
4-cyclohexyl-1-(3,4-dimethylphenyl)-N-ethylbutan-2-amine
CID 63527108
4-cyclohexyl-1-(3,5-difluorophenyl)-N-ethylbutan-2-amine
CID 105412616
1-(3-chloro-4-fluorophenyl)-4-cyclopentyl-N-ethylbutan-2-amine
CID 103043472
1-cyclohexylsulfanyl-N-ethyl-3-phenylpropan-2-amine
CID 65144146
4-cyclopentyl-1-(2,5-dichlorophenyl)-N-ethylbutan-2-amine
CID 115863120
N-(cyclobutylmethyl)-1-phenylbutan-2-amine
CID 79007195
1-(4-tert-butylphenyl)-3-cyclobutyl-N-ethylpropan-2-amine
CID 103168468
(1-cyclohexyl-5-phenylpentan-3-yl)hydrazine
CID 105285878
[4-cyclopentyl-1-(4-methylphenyl)butan-2-yl]hydrazine
CID 105284261
1-cyclohexyl-N-methyl-6-phenylhexan-3-amine
CID 115849338

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine?
The IUPAC name of 4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine (CID 63526556) is 4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine.
What is the SMILES notation for 4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine?
The canonical SMILES for 4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine is CCNC(CCC1CCCC1)Cc1ccccc1.
What is the InChIKey of 4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine?
The InChIKey is URIFDQIVXVTZSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N/c1-2-18-17(13-12-15-8-6-7-9-15)14-16-10-4-3-5-11-16/h3-5,10-11,15,17-18H,2,6-9,12-14H2,1H3.
What are the key properties of 4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine?
4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine has a molecular weight of 245.41 g/mol, XLogP of 4.18, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine is sourced from PubChem (CID 63526556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).