4-[1-(2-cyclopentylethylamino)ethyl]phenol

C15H23NO — CID 54932146

IUPAC4-[1-(2-cyclopentylethylamino)ethyl]phenol
SMILESCC(NCCC1CCCC1)c1ccc(O)cc1
InChIInChI=1S/C15H23NO/c1-12(14-6-8-15(17)9-7-14)16-11-10-13-4-2-3-5-13/h6-9,12-13,16-17H,2-5,10-11H2,1H3
InChIKeyXHEOUIYYPBWPEQ-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.62
Rot. Bonds5

About 4-[1-(2-cyclopentylethylamino)ethyl]phenol

4-[1-(2-cyclopentylethylamino)ethyl]phenol (PubChem CID 54932146) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 4-[1-(2-cyclopentylethylamino)ethyl]phenol.

Molecular Properties

Compound Name4-[1-(2-cyclopentylethylamino)ethyl]phenol
PubChem CID54932146
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name4-[1-(2-cyclopentylethylamino)ethyl]phenol
SMILESCC(NCCC1CCCC1)c1ccc(O)cc1
InChIInChI=1S/C15H23NO/c1-12(14-6-8-15(17)9-7-14)16-11-10-13-4-2-3-5-13/h6-9,12-13,16-17H,2-5,10-11H2,1H3
InChIKeyXHEOUIYYPBWPEQ-UHFFFAOYSA-N
XLogP3.62
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyclohexylethyl)-1-(4-iodophenyl)ethanamine
CID 63448536
N-(2-cyclopentylethyl)-1-(4-ethylphenyl)ethanamine
CID 63450481
(1R)-1-(4-bromophenyl)-N-(2-cyclohexylethyl)ethanamine
CID 81354090
N-(2-cyclobutylethyl)-1-(4-fluorophenyl)ethanamine
CID 115688583
N-(2-cyclobutylethyl)-1-phenylethanamine
CID 115688569
5-[1-(3-cyclopentylpropylamino)ethyl]benzene-1,3-diol
CID 106008779
1-(4-butylphenyl)-N-(2-cyclopentylethyl)ethanamine
CID 63450221
N-(2-cyclopentylethyl)-1-[4-(2-methylpropoxy)phenyl]ethanamine
CID 63450652
4-[1-(2-cyclohexylethylamino)ethyl]-2-methoxyphenol
CID 60919457
4-[1-(2-cyclobutylethylamino)ethyl]benzene-1,3-diol
CID 113478638
N-(2-cyclopentylethyl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine
CID 63450607
2-[1-(2-cyclohexylethylamino)ethyl]phenol
CID 54931684

Frequently Asked Questions

What is the IUPAC name of 4-[1-(2-cyclopentylethylamino)ethyl]phenol?
The IUPAC name of 4-[1-(2-cyclopentylethylamino)ethyl]phenol (CID 54932146) is 4-[1-(2-cyclopentylethylamino)ethyl]phenol.
What is the SMILES notation for 4-[1-(2-cyclopentylethylamino)ethyl]phenol?
The canonical SMILES for 4-[1-(2-cyclopentylethylamino)ethyl]phenol is CC(NCCC1CCCC1)c1ccc(O)cc1.
What is the InChIKey of 4-[1-(2-cyclopentylethylamino)ethyl]phenol?
The InChIKey is XHEOUIYYPBWPEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12(14-6-8-15(17)9-7-14)16-11-10-13-4-2-3-5-13/h6-9,12-13,16-17H,2-5,10-11H2,1H3.
What are the key properties of 4-[1-(2-cyclopentylethylamino)ethyl]phenol?
4-[1-(2-cyclopentylethylamino)ethyl]phenol has a molecular weight of 233.36 g/mol, XLogP of 3.62, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2-cyclopentylethylamino)ethyl]phenol is sourced from PubChem (CID 54932146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).