N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine

C19H31NO — CID 104748610

IUPACN-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine
SMILESCCCNC(COc1ccccc1C(C)C)C1CCCC1
InChIInChI=1S/C19H31NO/c1-4-13-20-18(16-9-5-6-10-16)14-21-19-12-8-7-11-17(19)15(2)3/h7-8,11-12,15-16,18,20H,4-6,9-10,13-14H2,1-3H3
InChIKeyHGWGYNRECLCTED-UHFFFAOYSA-N
MW289.46 g/mol
LogP4.75
Rot. Bonds8

About N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine

N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine (PubChem CID 104748610) has the molecular formula C19H31NO and a molecular weight of 289.46 g/mol. Its IUPAC name is N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine
PubChem CID104748610
Molecular FormulaC19H31NO
Molecular Weight289.46 g/mol
Exact Mass289.24
IUPAC NameN-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine
SMILESCCCNC(COc1ccccc1C(C)C)C1CCCC1
InChIInChI=1S/C19H31NO/c1-4-13-20-18(16-9-5-6-10-16)14-21-19-12-8-7-11-17(19)15(2)3/h7-8,11-12,15-16,18,20H,4-6,9-10,13-14H2,1-3H3
InChIKeyHGWGYNRECLCTED-UHFFFAOYSA-N
XLogP4.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.46
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-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

N-[1-cyclopentyl-2-(2-ethoxyphenoxy)ethyl]propan-1-amine
CID 104748399
N-[2-(2-chlorophenoxy)-1-cyclopentylethyl]propan-1-amine
CID 104749295
1-cyclopropyl-N-methyl-2-(2-propan-2-ylphenoxy)ethanamine
CID 63915324
N-[cyclopentyl-(2-ethoxyphenyl)methyl]propan-1-amine
CID 62802061
N-[1-cyclohexyl-2-(2,4-difluorophenoxy)ethyl]propan-1-amine
CID 104748323
N-[cyclobutyl-(2-ethoxyphenyl)methyl]propan-1-amine
CID 64987111
N-[2-(3-chlorophenoxy)-1-cyclopentylethyl]propan-1-amine
CID 105080955
1-methoxy-3-(2-propan-2-ylphenoxy)-N-propylpropan-2-amine
CID 107506613
N-[2-(2-ethoxyphenoxy)-1-(oxolan-3-yl)ethyl]propan-1-amine
CID 104748410
N-[2-(5-chloro-2-methylphenoxy)-1-cyclohexylethyl]propan-1-amine
CID 104749569
N-[1-cyclopentyl-2-(4-ethylphenoxy)ethyl]propan-1-amine
CID 104748438
1-cyclopentyl-N-ethyl-2-(2-fluorophenoxy)ethanamine
CID 113448545

Frequently Asked Questions

What is the IUPAC name of N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine?
The IUPAC name of N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine (CID 104748610) is N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine.
What is the SMILES notation for N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine?
The canonical SMILES for N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine is CCCNC(COc1ccccc1C(C)C)C1CCCC1.
What is the InChIKey of N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine?
The InChIKey is HGWGYNRECLCTED-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31NO/c1-4-13-20-18(16-9-5-6-10-16)14-21-19-12-8-7-11-17(19)15(2)3/h7-8,11-12,15-16,18,20H,4-6,9-10,13-14H2,1-3H3.
What are the key properties of N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine?
N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine has a molecular weight of 289.46 g/mol, XLogP of 4.75, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethyl]propan-1-amine is sourced from PubChem (CID 104748610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).