[3-(naphthalen-2-ylmethylideneamino)phenyl]methanol

C18H15NO — CID 786243

IUPAC[3-(naphthalen-2-ylmethylideneamino)phenyl]methanol
SMILESOCc1cccc(/N=C/c2ccc3ccccc3c2)c1
InChIInChI=1S/C18H15NO/c20-13-15-4-3-7-18(11-15)19-12-14-8-9-16-5-1-2-6-17(16)10-14/h1-12,20H,13H2/b19-12+
InChIKeyWUJZDIUKAPORQY-XDHOZWIPSA-N
MW261.32 g/mol
LogP4.08
Rot. Bonds3

About [3-(naphthalen-2-ylmethylideneamino)phenyl]methanol

[3-(naphthalen-2-ylmethylideneamino)phenyl]methanol (PubChem CID 786243) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is [3-(naphthalen-2-ylmethylideneamino)phenyl]methanol.

Molecular Properties

Compound Name[3-(naphthalen-2-ylmethylideneamino)phenyl]methanol
PubChem CID786243
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC Name[3-(naphthalen-2-ylmethylideneamino)phenyl]methanol
SMILESOCc1cccc(/N=C/c2ccc3ccccc3c2)c1
InChIInChI=1S/C18H15NO/c20-13-15-4-3-7-18(11-15)19-12-14-8-9-16-5-1-2-6-17(16)10-14/h1-12,20H,13H2/b19-12+
InChIKeyWUJZDIUKAPORQY-XDHOZWIPSA-N
XLogP4.08
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [3-(naphthalen-2-ylmethylideneamino)phenyl]methanol?
The IUPAC name of [3-(naphthalen-2-ylmethylideneamino)phenyl]methanol (CID 786243) is [3-(naphthalen-2-ylmethylideneamino)phenyl]methanol.
What is the SMILES notation for [3-(naphthalen-2-ylmethylideneamino)phenyl]methanol?
The canonical SMILES for [3-(naphthalen-2-ylmethylideneamino)phenyl]methanol is OCc1cccc(/N=C/c2ccc3ccccc3c2)c1.
What is the InChIKey of [3-(naphthalen-2-ylmethylideneamino)phenyl]methanol?
The InChIKey is WUJZDIUKAPORQY-XDHOZWIPSA-N. The full InChI is InChI=1S/C18H15NO/c20-13-15-4-3-7-18(11-15)19-12-14-8-9-16-5-1-2-6-17(16)10-14/h1-12,20H,13H2/b19-12+.
What are the key properties of [3-(naphthalen-2-ylmethylideneamino)phenyl]methanol?
[3-(naphthalen-2-ylmethylideneamino)phenyl]methanol has a molecular weight of 261.32 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(naphthalen-2-ylmethylideneamino)phenyl]methanol is sourced from PubChem (CID 786243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).