2-(1-cyclohexylpropylamino)-1-phenylethanol

C17H27NO — CID 62405750

IUPAC2-(1-cyclohexylpropylamino)-1-phenylethanol
SMILESCCC(NCC(O)c1ccccc1)C1CCCCC1
InChIInChI=1S/C17H27NO/c1-2-16(14-9-5-3-6-10-14)18-13-17(19)15-11-7-4-8-12-15/h4,7-8,11-12,14,16-19H,2-3,5-6,9-10,13H2,1H3
InChIKeyUAIGKWPAHHLWML-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.67
Rot. Bonds6

About 2-(1-cyclohexylpropylamino)-1-phenylethanol

2-(1-cyclohexylpropylamino)-1-phenylethanol (PubChem CID 62405750) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is 2-(1-cyclohexylpropylamino)-1-phenylethanol.

Molecular Properties

Compound Name2-(1-cyclohexylpropylamino)-1-phenylethanol
PubChem CID62405750
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC Name2-(1-cyclohexylpropylamino)-1-phenylethanol
SMILESCCC(NCC(O)c1ccccc1)C1CCCCC1
InChIInChI=1S/C17H27NO/c1-2-16(14-9-5-3-6-10-14)18-13-17(19)15-11-7-4-8-12-15/h4,7-8,11-12,14,16-19H,2-3,5-6,9-10,13H2,1H3
InChIKeyUAIGKWPAHHLWML-UHFFFAOYSA-N
XLogP3.67
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(1-cyclohexylpropylamino)-1-phenylethanol 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-(2-phenylpropyl)propan-1-amine
CID 63477318
2-[[(1R)-1-cyclohexylethyl]amino]-1-phenylethanol
CID 81386513
2-(1-cyclohexylpropylamino)-1-(3,4-difluorophenyl)ethanol
CID 62406830
2-(1-cyclohexylpropylamino)-1-(furan-2-yl)ethanol
CID 62406474
2-(1-cyclohexylpropylamino)-1-(2,6-difluorophenyl)ethanol
CID 62406831
(1R)-2-[[(S)-cyclohexyl(phenyl)methyl]amino]-1-pyridin-4-ylethanol
CID 97258708
(1S)-2-[[(R)-cyclohexyl(phenyl)methyl]amino]-1-pyridin-4-ylethanol
CID 97258709
1-cyclohexyl-N-(3-phenylprop-2-ynyl)propan-1-amine
CID 55069022
3-(1-cyclohexylpropylamino)propane-1,2-diol
CID 76943229
2-chloro-N-(1-cyclohexylpropyl)-2-phenylacetamide
CID 62407196
(R)-cycloheptyl(phenyl)methanol
CID 94502427
2-amino-3-(1-cyclohexylpropylamino)propanoic acid
CID 103249979

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohexylpropylamino)-1-phenylethanol?
The IUPAC name of 2-(1-cyclohexylpropylamino)-1-phenylethanol (CID 62405750) is 2-(1-cyclohexylpropylamino)-1-phenylethanol.
What is the SMILES notation for 2-(1-cyclohexylpropylamino)-1-phenylethanol?
The canonical SMILES for 2-(1-cyclohexylpropylamino)-1-phenylethanol is CCC(NCC(O)c1ccccc1)C1CCCCC1.
What is the InChIKey of 2-(1-cyclohexylpropylamino)-1-phenylethanol?
The InChIKey is UAIGKWPAHHLWML-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c1-2-16(14-9-5-3-6-10-14)18-13-17(19)15-11-7-4-8-12-15/h4,7-8,11-12,14,16-19H,2-3,5-6,9-10,13H2,1H3.
What are the key properties of 2-(1-cyclohexylpropylamino)-1-phenylethanol?
2-(1-cyclohexylpropylamino)-1-phenylethanol has a molecular weight of 261.41 g/mol, XLogP of 3.67, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexylpropylamino)-1-phenylethanol is sourced from PubChem (CID 62405750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).