1-(benzylideneamino)-1-phenylethanol

C15H15NO — CID 154107002

IUPAC1-(benzylideneamino)-1-phenylethanol
SMILESCC(O)(N=Cc1ccccc1)c1ccccc1
InChIInChI=1S/C15H15NO/c1-15(17,14-10-6-3-7-11-14)16-12-13-8-4-2-5-9-13/h2-12,17H,1H3
InChIKeyRNWMLVDVTZAUIH-UHFFFAOYSA-N
MW225.29 g/mol
LogP2.97
Rot. Bonds3

About 1-(benzylideneamino)-1-phenylethanol

1-(benzylideneamino)-1-phenylethanol (PubChem CID 154107002) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 1-(benzylideneamino)-1-phenylethanol.

Molecular Properties

Compound Name1-(benzylideneamino)-1-phenylethanol
PubChem CID154107002
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name1-(benzylideneamino)-1-phenylethanol
SMILESCC(O)(N=Cc1ccccc1)c1ccccc1
InChIInChI=1S/C15H15NO/c1-15(17,14-10-6-3-7-11-14)16-12-13-8-4-2-5-9-13/h2-12,17H,1H3
InChIKeyRNWMLVDVTZAUIH-UHFFFAOYSA-N
XLogP2.97
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 52.97
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

3-(benzylideneamino)-3-methylbutan-2-ol
CID 130129023
N-tert-butyl-1-(3-tert-butylphenyl)methanimine
CID 22968786
(E)-1-phenyl-N-trityloxymethanimine
CID 5382595
(E)-N-[tert-butyl(dimethyl)silyl]-1-phenylmethanimine
CID 10943979
N-benzylidenehydroxylamine;ethane
CID 90698406
(NZ)-N-benzylidenehydroxylamine;ethane
CID 91038836
ethane;N-methyl-1-phenylmethanimine
CID 90887000
2-(benzylideneamino)-2-methylhexanoic acid
CID 174162002
[4-[1,1-bis[4-[hydroxy(diphenyl)methyl]phenyl]ethyl]phenyl]-diphenylmethanol
CID 153299511
(1-bromo-1-phenylethyl)benzene
CID 19019197
2-methylprop-2-enyl 2-(benzylideneamino)-2,2-diphenylacetate
CID 102321894
(2S,4R)-2,4-diphenylpentane-2,4-diol
CID 139037078

Frequently Asked Questions

What is the IUPAC name of 1-(benzylideneamino)-1-phenylethanol?
The IUPAC name of 1-(benzylideneamino)-1-phenylethanol (CID 154107002) is 1-(benzylideneamino)-1-phenylethanol.
What is the SMILES notation for 1-(benzylideneamino)-1-phenylethanol?
The canonical SMILES for 1-(benzylideneamino)-1-phenylethanol is CC(O)(N=Cc1ccccc1)c1ccccc1.
What is the InChIKey of 1-(benzylideneamino)-1-phenylethanol?
The InChIKey is RNWMLVDVTZAUIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-15(17,14-10-6-3-7-11-14)16-12-13-8-4-2-5-9-13/h2-12,17H,1H3.
What are the key properties of 1-(benzylideneamino)-1-phenylethanol?
1-(benzylideneamino)-1-phenylethanol has a molecular weight of 225.29 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzylideneamino)-1-phenylethanol is sourced from PubChem (CID 154107002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).