2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol

C15H16ClNO — CID 123458575

IUPAC2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol
SMILESCc1cccc(C(O)C(N)c2ccc(Cl)cc2)c1
InChIInChI=1S/C15H16ClNO/c1-10-3-2-4-12(9-10)15(18)14(17)11-5-7-13(16)8-6-11/h2-9,14-15,18H,17H2,1H3
InChIKeyWAZLSYVBAKRGFP-UHFFFAOYSA-N
MW261.75 g/mol
LogP3.38
Rot. Bonds3

About 2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol

2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol (PubChem CID 123458575) has the molecular formula C15H16ClNO and a molecular weight of 261.75 g/mol. Its IUPAC name is 2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol.

Molecular Properties

Compound Name2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol
PubChem CID123458575
Molecular FormulaC15H16ClNO
Molecular Weight261.75 g/mol
Exact Mass261.09
IUPAC Name2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol
SMILESCc1cccc(C(O)C(N)c2ccc(Cl)cc2)c1
InChIInChI=1S/C15H16ClNO/c1-10-3-2-4-12(9-10)15(18)14(17)11-5-7-13(16)8-6-11/h2-9,14-15,18H,17H2,1H3
InChIKeyWAZLSYVBAKRGFP-UHFFFAOYSA-N
XLogP3.38
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.75
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol 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

(2R)-2-amino-1-(3-chlorophenyl)-2-(4-chlorophenyl)ethanol
CID 89490826
(1S)-2-amino-1-(3-chlorophenyl)-2-(4-chlorophenyl)ethanol
CID 118631975
(2S)-2-amino-1-(3-chlorophenyl)-2-(4-chlorophenyl)ethanol
CID 118633773
2-amino-1-(3-chlorophenyl)-2-(4-propan-2-ylphenyl)ethanol
CID 123406451
(2R)-2-amino-1-(3-chlorophenyl)-2-(4-propan-2-ylphenyl)ethanol
CID 89490748
2-amino-1-(3-chloro-4-fluorophenyl)-2-(4-chlorophenyl)ethanol
CID 123991915
2-amino-1-(3,4-difluorophenyl)-2-phenylethanol
CID 62718129
(1R)-2-methyl-1-(3-methylphenyl)propan-1-amine
CID 45072365
(1S,2R)-1-amino-1-(4-chlorophenyl)-3-methylbutan-2-ol
CID 131000817
(1R,2R)-1-(3-methylphenyl)propane-1,2-diol
CID 134966873
2-amino-1-(3-chlorophenyl)-2-[4-(trifluoromethyl)phenyl]ethanol
CID 123373360
(1R)-1-amino-1-(4-chlorophenyl)propan-2-ol
CID 130676173

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol?
The IUPAC name of 2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol (CID 123458575) is 2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol.
What is the SMILES notation for 2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol?
The canonical SMILES for 2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol is Cc1cccc(C(O)C(N)c2ccc(Cl)cc2)c1.
What is the InChIKey of 2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol?
The InChIKey is WAZLSYVBAKRGFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO/c1-10-3-2-4-12(9-10)15(18)14(17)11-5-7-13(16)8-6-11/h2-9,14-15,18H,17H2,1H3.
What are the key properties of 2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol?
2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol has a molecular weight of 261.75 g/mol, XLogP of 3.38, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(4-chlorophenyl)-1-(3-methylphenyl)ethanol is sourced from PubChem (CID 123458575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).