(1S)-2-anilino-1-phenylethanol

C14H15NO — CID 39243263

IUPAC(1S)-2-anilino-1-phenylethanol
SMILESO[C@H](CNc1ccccc1)c1ccccc1
InChIInChI=1S/C14H15NO/c16-14(12-7-3-1-4-8-12)11-15-13-9-5-2-6-10-13/h1-10,14-16H,11H2/t14-/m1/s1
InChIKeyGGMOJBRNGQDSQN-CQSZACIVSA-N
MW213.28 g/mol
LogP2.83
Rot. Bonds4

About (1S)-2-anilino-1-phenylethanol

(1S)-2-anilino-1-phenylethanol (PubChem CID 39243263) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is (1S)-2-anilino-1-phenylethanol.

Molecular Properties

Compound Name(1S)-2-anilino-1-phenylethanol
PubChem CID39243263
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name(1S)-2-anilino-1-phenylethanol
SMILESO[C@H](CNc1ccccc1)c1ccccc1
InChIInChI=1S/C14H15NO/c16-14(12-7-3-1-4-8-12)11-15-13-9-5-2-6-10-13/h1-10,14-16H,11H2/t14-/m1/s1
InChIKeyGGMOJBRNGQDSQN-CQSZACIVSA-N
XLogP2.83
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1S)-2-anilino-1-phenylethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1S)-2-anilino-1-phenylethanol?
The IUPAC name of (1S)-2-anilino-1-phenylethanol (CID 39243263) is (1S)-2-anilino-1-phenylethanol.
What is the SMILES notation for (1S)-2-anilino-1-phenylethanol?
The canonical SMILES for (1S)-2-anilino-1-phenylethanol is O[C@H](CNc1ccccc1)c1ccccc1.
What is the InChIKey of (1S)-2-anilino-1-phenylethanol?
The InChIKey is GGMOJBRNGQDSQN-CQSZACIVSA-N. The full InChI is InChI=1S/C14H15NO/c16-14(12-7-3-1-4-8-12)11-15-13-9-5-2-6-10-13/h1-10,14-16H,11H2/t14-/m1/s1.
What are the key properties of (1S)-2-anilino-1-phenylethanol?
(1S)-2-anilino-1-phenylethanol has a molecular weight of 213.28 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-2-anilino-1-phenylethanol is sourced from PubChem (CID 39243263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).