dimethyl-oxo-phenylimino-lambda6-sulfane

C8H11NOS — CID 641996

IUPACdimethyl-oxo-phenylimino-lambda6-sulfane
SMILESCS(C)(=O)=Nc1ccccc1
InChIInChI=1S/C8H11NOS/c1-11(2,10)9-8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeyCXXZSRYALZVKCF-UHFFFAOYSA-N
MW169.25 g/mol
LogP2.05
Rot. Bonds1

About dimethyl-oxo-phenylimino-lambda6-sulfane

dimethyl-oxo-phenylimino-lambda6-sulfane (PubChem CID 641996) has the molecular formula C8H11NOS and a molecular weight of 169.25 g/mol. Its IUPAC name is dimethyl-oxo-phenylimino-lambda6-sulfane.

Molecular Properties

Compound Namedimethyl-oxo-phenylimino-lambda6-sulfane
PubChem CID641996
Molecular FormulaC8H11NOS
Molecular Weight169.25 g/mol
Exact Mass169.06
IUPAC Namedimethyl-oxo-phenylimino-lambda6-sulfane
SMILESCS(C)(=O)=Nc1ccccc1
InChIInChI=1S/C8H11NOS/c1-11(2,10)9-8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeyCXXZSRYALZVKCF-UHFFFAOYSA-N
XLogP2.05
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Benzenamine, N-sulfinyl-
CID 70739
Methanesulfonamide, N-phenyl-
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N-(2-Fluorophenyl)methanesulfonamide
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N-methyl-N-phenylmethanesulfonamide
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N-phenylethene-1-sulfonamide
CID 12322399
N-(2-iodophenyl)methanesulfonamide
CID 780001
((4-Bromophenyl)imino)dimethyl-lambda6-sulfanone
CID 323550
N-(4-iodophenyl)methanesulfonamide
CID 836147
1-fluoro-N-phenylmethanesulfonamide
CID 23273593
N-(3-fluorophenyl)methanesulfonamide
CID 772008
N-(4-fluorophenyl)methanesulfonamide
CID 773417
N,N-Di-(Me sulfonyl)-aniline
CID 459372

Frequently Asked Questions

What is the IUPAC name of dimethyl-oxo-phenylimino-lambda6-sulfane?
The IUPAC name of dimethyl-oxo-phenylimino-lambda6-sulfane (CID 641996) is dimethyl-oxo-phenylimino-lambda6-sulfane.
What is the SMILES notation for dimethyl-oxo-phenylimino-lambda6-sulfane?
The canonical SMILES for dimethyl-oxo-phenylimino-lambda6-sulfane is CS(C)(=O)=Nc1ccccc1.
What is the InChIKey of dimethyl-oxo-phenylimino-lambda6-sulfane?
The InChIKey is CXXZSRYALZVKCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NOS/c1-11(2,10)9-8-6-4-3-5-7-8/h3-7H,1-2H3.
What are the key properties of dimethyl-oxo-phenylimino-lambda6-sulfane?
dimethyl-oxo-phenylimino-lambda6-sulfane has a molecular weight of 169.25 g/mol, XLogP of 2.05, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-oxo-phenylimino-lambda6-sulfane is sourced from PubChem (CID 641996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).