2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol

C13H13NO — CID 135790005

IUPAC2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol
SMILESC/N=C(\C)c1ccc2ccccc2c1O
InChIInChI=1S/C13H13NO/c1-9(14-2)11-8-7-10-5-3-4-6-12(10)13(11)15/h3-8,15H,1-2H3/b14-9+
InChIKeyVERMPIURIXEWKY-NTEUORMPSA-N
MW199.25 g/mol
LogP2.98
Rot. Bonds1

About 2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol

2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol (PubChem CID 135790005) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is 2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol.

Molecular Properties

Compound Name2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol
PubChem CID135790005
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC Name2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol
SMILESC/N=C(\C)c1ccc2ccccc2c1O
InChIInChI=1S/C13H13NO/c1-9(14-2)11-8-7-10-5-3-4-6-12(10)13(11)15/h3-8,15H,1-2H3/b14-9+
InChIKeyVERMPIURIXEWKY-NTEUORMPSA-N
XLogP2.98
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 52.98
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

2-[(E)-N-[3-[(E)-1-(1-hydroxynaphthalen-2-yl)ethylideneamino]oxypropoxy]-C-methylcarbonimidoyl]naphthalen-1-ol
CID 139076819
1-(1-hydroxynaphthalen-2-yl)ethanone;vanadium
CID 174557605
1-(1-hydroxynaphthalen-2-yl)ethanone;vanadium;trichloride
CID 174494917
2-[(E)-C-methyl-N-(2,3,4,5,6-pentafluoroanilino)carbonimidoyl]naphthalen-1-ol
CID 135811561
2-[(E)-C-methyl-N-morpholin-4-ylcarbonimidoyl]naphthalen-1-ol
CID 136836678
2-hydroxy-N-[(Z)-1-(1-hydroxynaphthalen-2-yl)ethylideneamino]benzamide
CID 135887717
calcium bis(1-hydroxynaphthalene-2-carboxylate)
CID 139716025
N-[(E)-1-(1-hydroxynaphthalen-2-yl)ethylideneamino]hexanamide
CID 135601125
2-[N-(2,4-difluoroanilino)-C-methylcarbonimidoyl]naphthalen-1-ol
CID 5237787
3-hydroxy-N-[(E)-1-(1-hydroxynaphthalen-2-yl)ethylideneamino]benzamide
CID 135673825
2-[(E)-C-methyl-N-(2-nitroanilino)carbonimidoyl]naphthalen-1-ol
CID 135716763
N-(2-acetamidophenyl)-1-hydroxynaphthalene-2-carboxamide
CID 5133649

Frequently Asked Questions

What is the IUPAC name of 2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol?
The IUPAC name of 2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol (CID 135790005) is 2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol.
What is the SMILES notation for 2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol?
The canonical SMILES for 2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol is C/N=C(\C)c1ccc2ccccc2c1O.
What is the InChIKey of 2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol?
The InChIKey is VERMPIURIXEWKY-NTEUORMPSA-N. The full InChI is InChI=1S/C13H13NO/c1-9(14-2)11-8-7-10-5-3-4-6-12(10)13(11)15/h3-8,15H,1-2H3/b14-9+.
What are the key properties of 2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol?
2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol has a molecular weight of 199.25 g/mol, XLogP of 2.98, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(C,N-dimethylcarbonimidoyl)naphthalen-1-ol is sourced from PubChem (CID 135790005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).