1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol

C15H22ClNO — CID 60724617

IUPAC1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol
SMILESCC1CCC(NCC(O)c2ccc(Cl)cc2)CC1
InChIInChI=1S/C15H22ClNO/c1-11-2-8-14(9-3-11)17-10-15(18)12-4-6-13(16)7-5-12/h4-7,11,14-15,17-18H,2-3,8-10H2,1H3
InChIKeyKFGSIGNOSKXZFL-UHFFFAOYSA-N
MW267.80 g/mol
LogP3.54
Rot. Bonds4

About 1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol

1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol (PubChem CID 60724617) has the molecular formula C15H22ClNO and a molecular weight of 267.80 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol.

Molecular Properties

Compound Name1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol
PubChem CID60724617
Molecular FormulaC15H22ClNO
Molecular Weight267.80 g/mol
Exact Mass267.14
IUPAC Name1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol
SMILESCC1CCC(NCC(O)c2ccc(Cl)cc2)CC1
InChIInChI=1S/C15H22ClNO/c1-11-2-8-14(9-3-11)17-10-15(18)12-4-6-13(16)7-5-12/h4-7,11,14-15,17-18H,2-3,8-10H2,1H3
InChIKeyKFGSIGNOSKXZFL-UHFFFAOYSA-N
XLogP3.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.80
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-2-(cycloheptylamino)ethanol
CID 60724687
1-(4-tert-butylphenyl)-2-(cyclopropylamino)ethanol
CID 62775298
1-(4-aminophenyl)-2-(cyclopropylamino)ethanol
CID 115019175
2-(cycloheptylamino)-1-(4-propan-2-ylphenyl)ethanol
CID 60900441
2-[(3,5-dimethylcyclohexyl)amino]-1-(4-propan-2-ylphenyl)ethanol
CID 64733261
1-(4-aminophenyl)-2-(cyclopropylamino)ethanol;hydrochloride
CID 163728871
(1S)-2-(cycloheptylamino)-1-(4-methylphenyl)ethanol
CID 39350104
N-[2-(4-chlorophenyl)hexyl]cyclopropanamine
CID 79437438
1-(4-chlorophenyl)-2-(1-cyclopropylethylamino)ethanol
CID 60909738
1-(4-chlorophenyl)-2-[(2-methylsulfanylcyclohexyl)amino]ethanol
CID 103776488
(1S)-2-(cyclopentylamino)-1-(3,4-dichlorophenyl)ethanol
CID 94591374
2-(cyclobutylamino)-1-(4-methoxyphenyl)ethanol
CID 62414370

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol?
The IUPAC name of 1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol (CID 60724617) is 1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol.
What is the SMILES notation for 1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol?
The canonical SMILES for 1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol is CC1CCC(NCC(O)c2ccc(Cl)cc2)CC1.
What is the InChIKey of 1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol?
The InChIKey is KFGSIGNOSKXZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO/c1-11-2-8-14(9-3-11)17-10-15(18)12-4-6-13(16)7-5-12/h4-7,11,14-15,17-18H,2-3,8-10H2,1H3.
What are the key properties of 1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol?
1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol has a molecular weight of 267.80 g/mol, XLogP of 3.54, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-2-[(4-methylcyclohexyl)amino]ethanol is sourced from PubChem (CID 60724617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).