(1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol

C18H22ClNO — CID 70004278

IUPAC(1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol
SMILESCc1ccccc1CC(C)NC[C@H](O)c1ccccc1Cl
InChIInChI=1S/C18H22ClNO/c1-13-7-3-4-8-15(13)11-14(2)20-12-18(21)16-9-5-6-10-17(16)19/h3-10,14,18,20-21H,11-12H2,1-2H3/t14?,18-/m0/s1
InChIKeyAVZPWGDHIOIYMS-IBYPIGCZSA-N
MW303.83 g/mol
LogP3.90
Rot. Bonds6

About (1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol

(1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol (PubChem CID 70004278) has the molecular formula C18H22ClNO and a molecular weight of 303.83 g/mol. Its IUPAC name is (1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol.

Molecular Properties

Compound Name(1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol
PubChem CID70004278
Molecular FormulaC18H22ClNO
Molecular Weight303.83 g/mol
Exact Mass303.14
IUPAC Name(1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol
SMILESCc1ccccc1CC(C)NC[C@H](O)c1ccccc1Cl
InChIInChI=1S/C18H22ClNO/c1-13-7-3-4-8-15(13)11-14(2)20-12-18(21)16-9-5-6-10-17(16)19/h3-10,14,18,20-21H,11-12H2,1-2H3/t14?,18-/m0/s1
InChIKeyAVZPWGDHIOIYMS-IBYPIGCZSA-N
XLogP3.90
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.83
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]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

2-[1-(2-chlorophenyl)propan-2-ylamino]-1-(2-methoxyphenyl)ethanol
CID 18628145
1-(2-chlorophenyl)-2-(pentan-2-ylamino)ethanol
CID 60898219
1-(2-chlorophenyl)-2-[2-(2-methylphenyl)ethylamino]ethanol
CID 79749123
1-(2-chlorophenyl)-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]ethanol
CID 81378384
(1S)-1-(2-chlorophenyl)-2-(propan-2-ylamino)ethanol;hydrochloride
CID 76957004
(1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol
CID 70002682
1-[2-(2-chlorophenyl)-2-hydroxyethyl]-3-[(2-methylphenyl)methyl]urea
CID 111454036
1-(2,6-dichlorophenyl)-2-(2-methylphenyl)ethanol
CID 63016225
(1R)-2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]-1-[4-(trifluoromethyl)phenyl]ethanol
CID 54087155
sodium;1-(2-chlorophenyl)-2-(propan-2-ylamino)ethanol;hydride;hydrate;hydrochloride
CID 173081164
1-(2-chlorophenyl)-2-(3-methylpentan-2-ylamino)ethanol
CID 54950007
1-(2-chlorophenyl)-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethanol
CID 81408060

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol?
The IUPAC name of (1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol (CID 70004278) is (1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol.
What is the SMILES notation for (1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol?
The canonical SMILES for (1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol is Cc1ccccc1CC(C)NC[C@H](O)c1ccccc1Cl.
What is the InChIKey of (1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol?
The InChIKey is AVZPWGDHIOIYMS-IBYPIGCZSA-N. The full InChI is InChI=1S/C18H22ClNO/c1-13-7-3-4-8-15(13)11-14(2)20-12-18(21)16-9-5-6-10-17(16)19/h3-10,14,18,20-21H,11-12H2,1-2H3/t14?,18-/m0/s1.
What are the key properties of (1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol?
(1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol has a molecular weight of 303.83 g/mol, XLogP of 3.90, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol is sourced from PubChem (CID 70004278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).