N-naphthalen-1-yliminomethanesulfonamide

C11H10N2O2S — CID 166448164

IUPACN-naphthalen-1-yliminomethanesulfonamide
SMILESCS(=O)(=O)/N=N/c1cccc2ccccc12
InChIInChI=1S/C11H10N2O2S/c1-16(14,15)13-12-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3/b13-12+
InChIKeyHJVFVZAVUREJMT-OUKQBFOZSA-N
MW234.28 g/mol
LogP2.88
Rot. Bonds2

About N-naphthalen-1-yliminomethanesulfonamide

N-naphthalen-1-yliminomethanesulfonamide (PubChem CID 166448164) has the molecular formula C11H10N2O2S and a molecular weight of 234.28 g/mol. Its IUPAC name is N-naphthalen-1-yliminomethanesulfonamide.

Molecular Properties

Compound NameN-naphthalen-1-yliminomethanesulfonamide
PubChem CID166448164
Molecular FormulaC11H10N2O2S
Molecular Weight234.28 g/mol
Exact Mass234.05
IUPAC NameN-naphthalen-1-yliminomethanesulfonamide
SMILESCS(=O)(=O)/N=N/c1cccc2ccccc12
InChIInChI=1S/C11H10N2O2S/c1-16(14,15)13-12-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3/b13-12+
InChIKeyHJVFVZAVUREJMT-OUKQBFOZSA-N
XLogP2.88
TPSA58.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

CID 175078571
CID 175078571
methylsulfonylmethane;naphthalen-1-amine
CID 158608928
methyl-[4-(naphthalen-1-yldiazenyl)naphthalen-1-yl]diazene
CID 21337324
2,6-dimethyl-4-[(naphthalen-1-yldiazenyl)methylidene]cyclohexa-2,5-dien-1-one
CID 20683540
1-methylsulfonylnaphthalene
CID 11206535
3-(naphthalen-1-yldiazenyl)naphthalene-1,2-disulfonic acid
CID 87303681
(2-bromophenyl)-naphthalen-1-yldiazene
CID 581691
(4-methylphenyl)-naphthalen-1-yldiazene
CID 20700715
1-(2,6-dimethylphenyl)-N-naphthalen-1-ylmethanimine
CID 71530075
ethane;naphthalen-1-yl-(4-phenyldiazenylnaphthalen-1-yl)diazene
CID 91607155
(2-phenyldiazenylnaphthalen-1-yl) methanesulfonate
CID 91738311
CID 170845569
CID 170845569

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yliminomethanesulfonamide?
The IUPAC name of N-naphthalen-1-yliminomethanesulfonamide (CID 166448164) is N-naphthalen-1-yliminomethanesulfonamide.
What is the SMILES notation for N-naphthalen-1-yliminomethanesulfonamide?
The canonical SMILES for N-naphthalen-1-yliminomethanesulfonamide is CS(=O)(=O)/N=N/c1cccc2ccccc12.
What is the InChIKey of N-naphthalen-1-yliminomethanesulfonamide?
The InChIKey is HJVFVZAVUREJMT-OUKQBFOZSA-N. The full InChI is InChI=1S/C11H10N2O2S/c1-16(14,15)13-12-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3/b13-12+.
What are the key properties of N-naphthalen-1-yliminomethanesulfonamide?
N-naphthalen-1-yliminomethanesulfonamide has a molecular weight of 234.28 g/mol, XLogP of 2.88, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yliminomethanesulfonamide is sourced from PubChem (CID 166448164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).