2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol

C19H17NO — CID 134159652

IUPAC2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol
SMILESOC(C/N=C/c1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C19H17NO/c21-19(16-8-2-1-3-9-16)14-20-13-17-11-6-10-15-7-4-5-12-18(15)17/h1-13,19,21H,14H2/b20-13+
InChIKeyANJWWOMNCQVDLU-DEDYPNTBSA-N
MW275.35 g/mol
LogP3.99
Rot. Bonds4

About 2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol

2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol (PubChem CID 134159652) has the molecular formula C19H17NO and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol.

Molecular Properties

Compound Name2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol
PubChem CID134159652
Molecular FormulaC19H17NO
Molecular Weight275.35 g/mol
Exact Mass275.13
IUPAC Name2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol
SMILESOC(C/N=C/c1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C19H17NO/c21-19(16-8-2-1-3-9-16)14-20-13-17-11-6-10-15-7-4-5-12-18(15)17/h1-13,19,21H,14H2/b20-13+
InChIKeyANJWWOMNCQVDLU-DEDYPNTBSA-N
XLogP3.99
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 53.99
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

N'-[(E)-benzylideneamino]-3-hydroxy-3-(1-naphthyl)propanamidine
CID 49788263
3-hydroxy-3-(1-naphthyl)-N'-[(E)-p-tolylmethyleneamino]propanamidine
CID 118714226
N'-[(E)-(4-fluorophenyl)methyleneamino]-3-hydroxy-3-(1-naphthyl)propanamidine
CID 118714230
N'-[(E)-(2,4-difluorophenyl)methyleneamino]-3-hydroxy-3-(1-naphthyl)propanamidine
CID 118714232
N'-[(E)-(3,4-difluorophenyl)methyleneamino]-3-hydroxy-3-(1-naphthyl)propanamidine
CID 118714233
3-hydroxy-3-(2-naphthyl)-N'-[(E)-p-tolylmethyleneamino]propanamidine
CID 118714239
N'-[(E)-benzylideneamino]-2-hydroxy-2-(1-naphthyl)acetamidine
CID 118714224
2-(Dibutylamino)-1-(10-methylphenanthren-9-yl)ethanol
CID 320545
(1S,2S)-3-(dimethylamino)-2-(naphthalen-2-yl)-1-phenylpropan-1-ol
CID 9974625
Ethanol, 2-diethylamino-1-(phenanthr-3''-yl)-, hydrochloride
CID 110644
2-Amino-1-(phenanthren-2-yl)ethan-1-ol--hydrogen chloride (1/1)
CID 113857
Ethanol, 2-dimethylamino-1-(phenanthr-3''-yl)-, hydrochloride
CID 115486

Frequently Asked Questions

What is the IUPAC name of 2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol?
The IUPAC name of 2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol (CID 134159652) is 2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol.
What is the SMILES notation for 2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol?
The canonical SMILES for 2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol is OC(C/N=C/c1cccc2ccccc12)c1ccccc1.
What is the InChIKey of 2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol?
The InChIKey is ANJWWOMNCQVDLU-DEDYPNTBSA-N. The full InChI is InChI=1S/C19H17NO/c21-19(16-8-2-1-3-9-16)14-20-13-17-11-6-10-15-7-4-5-12-18(15)17/h1-13,19,21H,14H2/b20-13+.
What are the key properties of 2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol?
2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol has a molecular weight of 275.35 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(naphthalen-1-ylmethylideneamino)-1-phenylethanol is sourced from PubChem (CID 134159652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).