1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol

C17H14N2O — CID 137146492

IUPAC1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol
SMILESC/N=C(\c1cccnc1)c1c(O)ccc2ccccc12
InChIInChI=1S/C17H14N2O/c1-18-17(13-6-4-10-19-11-13)16-14-7-3-2-5-12(14)8-9-15(16)20/h2-11,20H,1H3/b18-17+
InChIKeyBRVYIARGZAPPIJ-ISLYRVAYSA-N
MW262.31 g/mol
LogP3.41
Rot. Bonds2

About 1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol

1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol (PubChem CID 137146492) has the molecular formula C17H14N2O and a molecular weight of 262.31 g/mol. Its IUPAC name is 1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol.

Molecular Properties

Compound Name1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol
PubChem CID137146492
Molecular FormulaC17H14N2O
Molecular Weight262.31 g/mol
Exact Mass262.11
IUPAC Name1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol
SMILESC/N=C(\c1cccnc1)c1c(O)ccc2ccccc12
InChIInChI=1S/C17H14N2O/c1-18-17(13-6-4-10-19-11-13)16-14-7-3-2-5-12(14)8-9-15(16)20/h2-11,20H,1H3/b18-17+
InChIKeyBRVYIARGZAPPIJ-ISLYRVAYSA-N
XLogP3.41
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol?
The IUPAC name of 1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol (CID 137146492) is 1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol.
What is the SMILES notation for 1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol?
The canonical SMILES for 1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol is C/N=C(\c1cccnc1)c1c(O)ccc2ccccc12.
What is the InChIKey of 1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol?
The InChIKey is BRVYIARGZAPPIJ-ISLYRVAYSA-N. The full InChI is InChI=1S/C17H14N2O/c1-18-17(13-6-4-10-19-11-13)16-14-7-3-2-5-12(14)8-9-15(16)20/h2-11,20H,1H3/b18-17+.
What are the key properties of 1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol?
1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol has a molecular weight of 262.31 g/mol, XLogP of 3.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(N-methyl-C-pyridin-3-ylcarbonimidoyl)naphthalen-2-ol is sourced from PubChem (CID 137146492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).