(2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol

C11H16ClNO — CID 103906814

IUPAC(2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol
SMILESCC(NC[C@@H](C)O)c1ccccc1Cl
InChIInChI=1S/C11H16ClNO/c1-8(14)7-13-9(2)10-5-3-4-6-11(10)12/h3-6,8-9,13-14H,7H2,1-2H3/t8-,9?/m1/s1
InChIKeyXMKDVTOIWFRKQX-VEDVMXKPSA-N
MW213.71 g/mol
LogP2.37
Rot. Bonds4

About (2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol

(2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol (PubChem CID 103906814) has the molecular formula C11H16ClNO and a molecular weight of 213.71 g/mol. Its IUPAC name is (2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol
PubChem CID103906814
Molecular FormulaC11H16ClNO
Molecular Weight213.71 g/mol
Exact Mass213.09
IUPAC Name(2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol
SMILESCC(NC[C@@H](C)O)c1ccccc1Cl
InChIInChI=1S/C11H16ClNO/c1-8(14)7-13-9(2)10-5-3-4-6-11(10)12/h3-6,8-9,13-14H,7H2,1-2H3/t8-,9?/m1/s1
InChIKeyXMKDVTOIWFRKQX-VEDVMXKPSA-N
XLogP2.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.71
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol 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-(2-chlorophenyl)-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]ethanol
CID 81378384
1-[1-(2-chlorophenyl)ethylamino]-3-methylbutan-2-ol
CID 111755606
N-[(1R)-1-(2-chlorophenyl)ethyl]-2,2-difluoroethanamine
CID 81378188
1-[[(1R)-1-(2-methylphenyl)ethyl]amino]propan-2-ol
CID 81375054
(2S)-1-[[(1R)-1-(2,4-dichlorophenyl)ethyl]amino]propan-2-ol
CID 93082094
(2R)-1-[[(1S)-1-(2,5-dichlorophenyl)ethyl]amino]propan-2-ol
CID 93082097
(2S)-1-[1-(2,5-dichlorophenyl)ethylamino]propan-2-ol
CID 103906527
1-[1-(2-chlorophenyl)ethylamino]-3-pyrrolidin-1-ylpropan-2-ol
CID 60729320
1-(2-chlorophenyl)-2-[[(1R)-1-(2-fluorophenyl)ethyl]amino]ethanol
CID 81380433
N-[(1S)-1-(2-chlorophenyl)ethyl]-2,2-diethoxyethanamine
CID 81378877
N-[1-(2-chlorophenyl)ethyl]-3-methyl-2-phenylbutan-1-amine
CID 107875843
N-[1-(2-chlorophenyl)ethyl]-2-cyclopropylpropan-1-amine
CID 115623733

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol?
The IUPAC name of (2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol (CID 103906814) is (2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol.
What is the SMILES notation for (2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol?
The canonical SMILES for (2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol is CC(NC[C@@H](C)O)c1ccccc1Cl.
What is the InChIKey of (2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol?
The InChIKey is XMKDVTOIWFRKQX-VEDVMXKPSA-N. The full InChI is InChI=1S/C11H16ClNO/c1-8(14)7-13-9(2)10-5-3-4-6-11(10)12/h3-6,8-9,13-14H,7H2,1-2H3/t8-,9?/m1/s1.
What are the key properties of (2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol?
(2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol has a molecular weight of 213.71 g/mol, XLogP of 2.37, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[1-(2-chlorophenyl)ethylamino]propan-2-ol is sourced from PubChem (CID 103906814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).