2-[(3-ethylcyclopentyl)amino]-2-phenylethanol

C15H23NO — CID 64500919

IUPAC2-[(3-ethylcyclopentyl)amino]-2-phenylethanol
SMILESCCC1CCC(NC(CO)c2ccccc2)C1
InChIInChI=1S/C15H23NO/c1-2-12-8-9-14(10-12)16-15(11-17)13-6-4-3-5-7-13/h3-7,12,14-17H,2,8-11H2,1H3
InChIKeyBEQCYXDNGOOOAC-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.89
Rot. Bonds5

About 2-[(3-ethylcyclopentyl)amino]-2-phenylethanol

2-[(3-ethylcyclopentyl)amino]-2-phenylethanol (PubChem CID 64500919) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-[(3-ethylcyclopentyl)amino]-2-phenylethanol.

Molecular Properties

Compound Name2-[(3-ethylcyclopentyl)amino]-2-phenylethanol
PubChem CID64500919
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name2-[(3-ethylcyclopentyl)amino]-2-phenylethanol
SMILESCCC1CCC(NC(CO)c2ccccc2)C1
InChIInChI=1S/C15H23NO/c1-2-12-8-9-14(10-12)16-15(11-17)13-6-4-3-5-7-13/h3-7,12,14-17H,2,8-11H2,1H3
InChIKeyBEQCYXDNGOOOAC-UHFFFAOYSA-N
XLogP2.89
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 ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-[(3-aminocyclopentyl)amino]-2-phenylethanol
CID 107862243
(2S)-2-(cyclopropylamino)-2-phenylethanol
CID 93471499
4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine
CID 55194080
(2S)-2-phenyl-2-[(4-propan-2-ylcyclohexyl)amino]ethanol
CID 103784113
(2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol
CID 103788675
(2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol
CID 103788767
tert-butyl N-[3-[[(1R)-2-hydroxy-1-phenylethyl]amino]cyclopentyl]carbamate
CID 107862557
(2S)-2-[(1,1-dioxothian-4-yl)amino]-2-phenylethanol
CID 114010168
3-ethyl-N-[(1S)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine
CID 81360857
4-ethyl-N-(2-methyl-1-phenylpropyl)cycloheptan-1-amine
CID 65083894
2-[[3-(4-methylphenyl)cyclobutyl]amino]-2-phenylethanol
CID 63182335
(2R)-2-(cyclopropylmethylamino)-2-phenylethanol
CID 93471769

Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethylcyclopentyl)amino]-2-phenylethanol?
The IUPAC name of 2-[(3-ethylcyclopentyl)amino]-2-phenylethanol (CID 64500919) is 2-[(3-ethylcyclopentyl)amino]-2-phenylethanol.
What is the SMILES notation for 2-[(3-ethylcyclopentyl)amino]-2-phenylethanol?
The canonical SMILES for 2-[(3-ethylcyclopentyl)amino]-2-phenylethanol is CCC1CCC(NC(CO)c2ccccc2)C1.
What is the InChIKey of 2-[(3-ethylcyclopentyl)amino]-2-phenylethanol?
The InChIKey is BEQCYXDNGOOOAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-12-8-9-14(10-12)16-15(11-17)13-6-4-3-5-7-13/h3-7,12,14-17H,2,8-11H2,1H3.
What are the key properties of 2-[(3-ethylcyclopentyl)amino]-2-phenylethanol?
2-[(3-ethylcyclopentyl)amino]-2-phenylethanol has a molecular weight of 233.36 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethylcyclopentyl)amino]-2-phenylethanol is sourced from PubChem (CID 64500919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).