4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol

C18H15NO — CID 832580

IUPAC4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol
SMILESCc1ccc(O)c(/N=C/c2cccc3ccccc23)c1
InChIInChI=1S/C18H15NO/c1-13-9-10-18(20)17(11-13)19-12-15-7-4-6-14-5-2-3-8-16(14)15/h2-12,20H,1H3/b19-12+
InChIKeyJLJRJSRPGQMKDQ-XDHOZWIPSA-N
MW261.32 g/mol
LogP4.60
Rot. Bonds2

About 4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol

4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol (PubChem CID 832580) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is 4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol.

Molecular Properties

Compound Name4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol
PubChem CID832580
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC Name4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol
SMILESCc1ccc(O)c(/N=C/c2cccc3ccccc23)c1
InChIInChI=1S/C18H15NO/c1-13-9-10-18(20)17(11-13)19-12-15-7-4-6-14-5-2-3-8-16(14)15/h2-12,20H,1H3/b19-12+
InChIKeyJLJRJSRPGQMKDQ-XDHOZWIPSA-N
XLogP4.60
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_phenol_A(3)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-(2,4-dimethylphenyl)-1-naphthalen-1-ylmethanimine
CID 1381168
2-[[3-[(2-hydroxy-5-methylphenyl)methylideneamino]naphthalen-2-yl]iminomethyl]-4-methylphenol
CID 137037421
N-[2-methyl-4-[3-methyl-4-(naphthalen-1-ylmethylideneamino)phenyl]phenyl]-1-naphthalen-1-ylmethanimine
CID 2195225
2-[(2-fluoro-5-methylphenyl)iminomethyl]phenol
CID 4857118
4-methyl-2-[(2-methylphenyl)iminomethyl]phenol
CID 136675822
N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine
CID 21210393
(E)-N-[4,6-bis[(E)-naphthalen-1-ylmethylideneamino]-1,3,5-triazin-2-yl]-1-naphthalen-1-ylmethanimine
CID 22086741
1-naphthalen-1-yl-N-phenylmethanimine
CID 615538
1-[2-hydroxy-3-[(2-hydroxyphenyl)iminomethyl]naphthalen-1-yl]-3-[(2-hydroxyphenyl)iminomethyl]naphthalen-2-ol
CID 136596197
2-[(2-methylphenyl)methylideneamino]phenol
CID 11009223
4-benzyl-2-[(2-hydroxy-5-methylphenyl)iminomethyl]-6-nitrophenol
CID 3923756
2-[(4-methylphenyl)iminomethyl]naphthalen-1-ol
CID 135953527

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol?
The IUPAC name of 4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol (CID 832580) is 4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol.
What is the SMILES notation for 4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol?
The canonical SMILES for 4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol is Cc1ccc(O)c(/N=C/c2cccc3ccccc23)c1.
What is the InChIKey of 4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol?
The InChIKey is JLJRJSRPGQMKDQ-XDHOZWIPSA-N. The full InChI is InChI=1S/C18H15NO/c1-13-9-10-18(20)17(11-13)19-12-15-7-4-6-14-5-2-3-8-16(14)15/h2-12,20H,1H3/b19-12+.
What are the key properties of 4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol?
4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol has a molecular weight of 261.32 g/mol, XLogP of 4.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol is sourced from PubChem (CID 832580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).