(2S)-2-(benzylideneamino)-2-phenylethanol

C15H15NO — CID 11957857

IUPAC(2S)-2-(benzylideneamino)-2-phenylethanol
SMILESOC[C@@H](/N=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15NO/c17-12-15(14-9-5-2-6-10-14)16-11-13-7-3-1-4-8-13/h1-11,15,17H,12H2/b16-11+/t15-/m1/s1
InChIKeyHEOGPWHVRWZHPH-YLQKULKDSA-N
MW225.29 g/mol
LogP2.84
Rot. Bonds4

About (2S)-2-(benzylideneamino)-2-phenylethanol

(2S)-2-(benzylideneamino)-2-phenylethanol (PubChem CID 11957857) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is (2S)-2-(benzylideneamino)-2-phenylethanol.

Molecular Properties

Compound Name(2S)-2-(benzylideneamino)-2-phenylethanol
PubChem CID11957857
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name(2S)-2-(benzylideneamino)-2-phenylethanol
SMILESOC[C@@H](/N=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15NO/c17-12-15(14-9-5-2-6-10-14)16-11-13-7-3-1-4-8-13/h1-11,15,17H,12H2/b16-11+/t15-/m1/s1
InChIKeyHEOGPWHVRWZHPH-YLQKULKDSA-N
XLogP2.84
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-((p-Fluorobenzylidene)amino)-3-phenyl-1-propanol
CID 208995
2-((p-Methylbenzylidene)amino)-3-phenyl-1-propanol
CID 208997
(E)-2-(Benzylideneamino)-1-phenylethanol
CID 2841414
2-(Benzylideneamino)-1-phenyl-1-propanol
CID 3342267
(3-Phenyl-2H-aziren-2-yl)methanol
CID 318519
(betaR)-beta-[(Phenylmethylene)amino]benzeneethanol
CID 10911227
5H-benzo[d][2]benzazepin-5-ol
CID 12328827
trans-2-(Benzylidenamino)-cyclohexanol
CID 15737537
3-(Hydroxymethyl)-3,4-di-hydroisoquinoline
CID 18663695
(S)-N-Benzylidene-1-methoxy-3-phenylpropan-2-amine
CID 383468
1-(Benzhydrylideneamino)-1-(3,4-difluorophenyl)propan-2-ol
CID 22049431
trifluoromethyl N-[(1S)-2-hydroxy-1-phenylethyl]methanimidate
CID 57689275

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(benzylideneamino)-2-phenylethanol?
The IUPAC name of (2S)-2-(benzylideneamino)-2-phenylethanol (CID 11957857) is (2S)-2-(benzylideneamino)-2-phenylethanol.
What is the SMILES notation for (2S)-2-(benzylideneamino)-2-phenylethanol?
The canonical SMILES for (2S)-2-(benzylideneamino)-2-phenylethanol is OC[C@@H](/N=C/c1ccccc1)c1ccccc1.
What is the InChIKey of (2S)-2-(benzylideneamino)-2-phenylethanol?
The InChIKey is HEOGPWHVRWZHPH-YLQKULKDSA-N. The full InChI is InChI=1S/C15H15NO/c17-12-15(14-9-5-2-6-10-14)16-11-13-7-3-1-4-8-13/h1-11,15,17H,12H2/b16-11+/t15-/m1/s1.
What are the key properties of (2S)-2-(benzylideneamino)-2-phenylethanol?
(2S)-2-(benzylideneamino)-2-phenylethanol has a molecular weight of 225.29 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(benzylideneamino)-2-phenylethanol is sourced from PubChem (CID 11957857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).