1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol

C18H16N2O — CID 135458877

IUPAC1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol
SMILESCN(/N=C/c1c(O)ccc2ccccc12)c1ccccc1
InChIInChI=1S/C18H16N2O/c1-20(15-8-3-2-4-9-15)19-13-17-16-10-6-5-7-14(16)11-12-18(17)21/h2-13,21H,1H3/b19-13+
InChIKeyYDSNHIHGCOYEKY-CPNJWEJPSA-N
MW276.34 g/mol
LogP4.02
Rot. Bonds3

About 1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol

1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol (PubChem CID 135458877) has the molecular formula C18H16N2O and a molecular weight of 276.34 g/mol. Its IUPAC name is 1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol
PubChem CID135458877
Molecular FormulaC18H16N2O
Molecular Weight276.34 g/mol
Exact Mass276.13
IUPAC Name1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol
SMILESCN(/N=C/c1c(O)ccc2ccccc12)c1ccccc1
InChIInChI=1S/C18H16N2O/c1-20(15-8-3-2-4-9-15)19-13-17-16-10-6-5-7-14(16)11-12-18(17)21/h2-13,21H,1H3/b19-13+
InChIKeyYDSNHIHGCOYEKY-CPNJWEJPSA-N
XLogP4.02
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-[(Z)-(diphenylhydrazinylidene)methyl]naphthalen-2-ol
CID 136690442
1-[[methyl(pyridin-2-yl)hydrazinylidene]methyl]naphthalen-2-ol
CID 3312166
[1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-yl] benzoate
CID 56688795
1-[(E)-hydroxyiminomethyl]naphthalen-2-ol
CID 135400485
1-[[2-[(2-hydroxynaphthalen-1-yl)methylideneamino]-1,2-diphenylethyl]iminomethyl]naphthalen-2-ol
CID 3576819
1-(propan-2-yliminomethyl)naphthalen-2-ol
CID 4779256
1-[[3-[(2-hydroxynaphthalen-1-yl)methylideneamino]-2,3-dimethylbutan-2-yl]iminomethyl]naphthalen-2-ol
CID 136675821
N-[3-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]-N-methylmethanesulfonamide
CID 137151299
N-methyl-N-[(E)-(10-methylacridin-10-ium-9-yl)methylideneamino]aniline
CID 58766161
1-(benzhydryliminomethyl)naphthalen-2-ol
CID 135592591
4-(dimethylamino)-N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]benzamide
CID 135465938
4-(dimethylamino)-N-[(Z)-(2-hydroxynaphthalen-1-yl)methylideneamino]benzamide
CID 136737019

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol?
The IUPAC name of 1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol (CID 135458877) is 1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol.
What is the SMILES notation for 1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol?
The canonical SMILES for 1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol is CN(/N=C/c1c(O)ccc2ccccc12)c1ccccc1.
What is the InChIKey of 1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol?
The InChIKey is YDSNHIHGCOYEKY-CPNJWEJPSA-N. The full InChI is InChI=1S/C18H16N2O/c1-20(15-8-3-2-4-9-15)19-13-17-16-10-6-5-7-14(16)11-12-18(17)21/h2-13,21H,1H3/b19-13+.
What are the key properties of 1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol?
1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol has a molecular weight of 276.34 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-[methyl(phenyl)hydrazinylidene]methyl]naphthalen-2-ol is sourced from PubChem (CID 135458877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).