methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane

C17H15NOS — CID 135008244

IUPACmethyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane
SMILESCS(=O)(=Nc1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C17H15NOS/c1-20(19,18-16-9-3-2-4-10-16)17-12-11-14-7-5-6-8-15(14)13-17/h2-13H,1H3
InChIKeyLYVSDLPLOXCLBV-UHFFFAOYSA-N
MW281.38 g/mol
LogP4.63
Rot. Bonds2

About methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane

methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane (PubChem CID 135008244) has the molecular formula C17H15NOS and a molecular weight of 281.38 g/mol. Its IUPAC name is methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane.

Molecular Properties

Compound Namemethyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane
PubChem CID135008244
Molecular FormulaC17H15NOS
Molecular Weight281.38 g/mol
Exact Mass281.09
IUPAC Namemethyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane
SMILESCS(=O)(=Nc1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C17H15NOS/c1-20(19,18-16-9-3-2-4-10-16)17-12-11-14-7-5-6-8-15(14)13-17/h2-13H,1H3
InChIKeyLYVSDLPLOXCLBV-UHFFFAOYSA-N
XLogP4.63
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.38
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane?
The IUPAC name of methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane (CID 135008244) is methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane.
What is the SMILES notation for methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane?
The canonical SMILES for methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane is CS(=O)(=Nc1ccccc1)c1ccc2ccccc2c1.
What is the InChIKey of methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane?
The InChIKey is LYVSDLPLOXCLBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NOS/c1-20(19,18-16-9-3-2-4-10-16)17-12-11-14-7-5-6-8-15(14)13-17/h2-13H,1H3.
What are the key properties of methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane?
methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane has a molecular weight of 281.38 g/mol, XLogP of 4.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-naphthalen-2-yl-oxo-phenylimino-λ6-sulfane is sourced from PubChem (CID 135008244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).