2-[(2-ethylcyclopentyl)amino]-1-phenylethanol

C15H23NO — CID 115706038

IUPAC2-[(2-ethylcyclopentyl)amino]-1-phenylethanol
SMILESCCC1CCCC1NCC(O)c1ccccc1
InChIInChI=1S/C15H23NO/c1-2-12-9-6-10-14(12)16-11-15(17)13-7-4-3-5-8-13/h3-5,7-8,12,14-17H,2,6,9-11H2,1H3
InChIKeyBEVBIRWKOWQFPZ-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.89
Rot. Bonds5

About 2-[(2-ethylcyclopentyl)amino]-1-phenylethanol

2-[(2-ethylcyclopentyl)amino]-1-phenylethanol (PubChem CID 115706038) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-[(2-ethylcyclopentyl)amino]-1-phenylethanol.

Molecular Properties

Compound Name2-[(2-ethylcyclopentyl)amino]-1-phenylethanol
PubChem CID115706038
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name2-[(2-ethylcyclopentyl)amino]-1-phenylethanol
SMILESCCC1CCCC1NCC(O)c1ccccc1
InChIInChI=1S/C15H23NO/c1-2-12-9-6-10-14(12)16-11-15(17)13-7-4-3-5-8-13/h3-5,7-8,12,14-17H,2,6,9-11H2,1H3
InChIKeyBEVBIRWKOWQFPZ-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

1-phenyl-2-[(2-propan-2-ylcyclohexyl)amino]ethanol
CID 81301234
2-ethyl-N-(3-phenylbutyl)cyclopentan-1-amine
CID 113483440
trans-(1S,2R)-2-ethyl-N-[(1S)-1-phenylethyl]cyclopentan-1-amine
CID 45095253
2-[(2-methyloxolan-3-yl)amino]-1-phenylethanol
CID 115335546
cis-(1S,2S)-2-ethyl-N-[(1S)-1-phenylethyl]cyclohexan-1-amine
CID 58193955
1-(2,4-difluorophenyl)-2-[(2-ethylcyclohexyl)amino]ethanol
CID 61467080
1-(2,5-dichlorophenyl)-2-[(2-ethylcyclohexyl)amino]ethanol
CID 63490841
1-[(2-ethylcyclopentyl)amino]pentan-2-ol
CID 115719434
1-cyclopentyl-2-[(2-ethylcyclopentyl)amino]ethanol
CID 115890580
N-benzyl-2-ethylcyclohexan-1-amine
CID 43434056
4-[1-hydroxy-2-[[2-(hydroxymethyl)cyclopentyl]amino]ethyl]benzonitrile
CID 106360637
N-(2,2-diphenylethyl)-N'-(3-ethyl-2-methylcyclohexyl)ethane-1,2-diamine
CID 67990569

Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethylcyclopentyl)amino]-1-phenylethanol?
The IUPAC name of 2-[(2-ethylcyclopentyl)amino]-1-phenylethanol (CID 115706038) is 2-[(2-ethylcyclopentyl)amino]-1-phenylethanol.
What is the SMILES notation for 2-[(2-ethylcyclopentyl)amino]-1-phenylethanol?
The canonical SMILES for 2-[(2-ethylcyclopentyl)amino]-1-phenylethanol is CCC1CCCC1NCC(O)c1ccccc1.
What is the InChIKey of 2-[(2-ethylcyclopentyl)amino]-1-phenylethanol?
The InChIKey is BEVBIRWKOWQFPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-12-9-6-10-14(12)16-11-15(17)13-7-4-3-5-8-13/h3-5,7-8,12,14-17H,2,6,9-11H2,1H3.
What are the key properties of 2-[(2-ethylcyclopentyl)amino]-1-phenylethanol?
2-[(2-ethylcyclopentyl)amino]-1-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-[(2-ethylcyclopentyl)amino]-1-phenylethanol is sourced from PubChem (CID 115706038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).