(1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol

C17H19Cl2NO — CID 70002682

IUPAC(1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol
SMILESCC(Cc1ccccc1Cl)NC[C@H](O)c1ccc(Cl)cc1
InChIInChI=1S/C17H19Cl2NO/c1-12(10-14-4-2-3-5-16(14)19)20-11-17(21)13-6-8-15(18)9-7-13/h2-9,12,17,20-21H,10-11H2,1H3/t12?,17-/m0/s1
InChIKeyGJYWSNKEAOIYNA-TYJDENFWSA-N
MW324.25 g/mol
LogP4.25
Rot. Bonds6

About (1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol

(1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol (PubChem CID 70002682) has the molecular formula C17H19Cl2NO and a molecular weight of 324.25 g/mol. Its IUPAC name is (1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol.

Molecular Properties

Compound Name(1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol
PubChem CID70002682
Molecular FormulaC17H19Cl2NO
Molecular Weight324.25 g/mol
Exact Mass323.08
IUPAC Name(1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol
SMILESCC(Cc1ccccc1Cl)NC[C@H](O)c1ccc(Cl)cc1
InChIInChI=1S/C17H19Cl2NO/c1-12(10-14-4-2-3-5-16(14)19)20-11-17(21)13-6-8-15(18)9-7-13/h2-9,12,17,20-21H,10-11H2,1H3/t12?,17-/m0/s1
InChIKeyGJYWSNKEAOIYNA-TYJDENFWSA-N
XLogP4.25
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.25
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(2-chlorophenyl)propan-2-ylamino]-1-(2-methoxyphenyl)ethanol
CID 18628145
4-[[2-(4-chlorophenyl)-2-hydroxyethyl]amino]pentan-2-ol
CID 113376212
(1S)-1-(4-chlorophenyl)-2-(propan-2-ylamino)ethanol
CID 42553219
1-(4-chlorophenyl)-2-[[(1R)-1-phenylethyl]amino]ethanol
CID 78953095
(1R)-1-(2-chlorophenyl)-2-[1-(2-methylphenyl)propan-2-ylamino]ethanol
CID 70004278
1-(2-chlorophenyl)-N-ethylpropan-2-amine
CID 43677539
2-[(2-chlorophenyl)methylamino]-1-(4-propan-2-ylphenyl)ethanol
CID 60896560
(1R)-2-[1-(2-methoxyphenyl)propan-2-ylamino]-1-(4-methylphenyl)ethanol
CID 70006145
2-(4-chlorophenyl)-N-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]acetamide
CID 54203052
(1R)-2-[[(2R)-1-(2-methylphenyl)propan-2-yl]amino]-1-[4-(trifluoromethyl)phenyl]ethanol
CID 54087155
N-[1-(2-chlorophenyl)propan-2-yl]-3,3-dimethylbutan-1-amine
CID 62964473
N-[2-(4-chlorophenyl)-2-hydroxyethyl]-2-methylpropanamide
CID 82117612

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol?
The IUPAC name of (1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol (CID 70002682) is (1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol.
What is the SMILES notation for (1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol?
The canonical SMILES for (1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol is CC(Cc1ccccc1Cl)NC[C@H](O)c1ccc(Cl)cc1.
What is the InChIKey of (1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol?
The InChIKey is GJYWSNKEAOIYNA-TYJDENFWSA-N. The full InChI is InChI=1S/C17H19Cl2NO/c1-12(10-14-4-2-3-5-16(14)19)20-11-17(21)13-6-8-15(18)9-7-13/h2-9,12,17,20-21H,10-11H2,1H3/t12?,17-/m0/s1.
What are the key properties of (1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol?
(1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol has a molecular weight of 324.25 g/mol, XLogP of 4.25, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(4-chlorophenyl)-2-[1-(2-chlorophenyl)propan-2-ylamino]ethanol is sourced from PubChem (CID 70002682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).