N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide

C14H15NO2S2 — CID 100547015

IUPACN-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide
SMILESC=CCN(c1ccccc1C)S(=O)(=O)c1cccs1
InChIInChI=1S/C14H15NO2S2/c1-3-10-15(13-8-5-4-7-12(13)2)19(16,17)14-9-6-11-18-14/h3-9,11H,1,10H2,2H3
InChIKeySAJGXCSXQQIXAN-UHFFFAOYSA-N
MW293.41 g/mol
LogP3.44
Rot. Bonds5

About N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide

N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide (PubChem CID 100547015) has the molecular formula C14H15NO2S2 and a molecular weight of 293.41 g/mol. Its IUPAC name is N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide
PubChem CID100547015
Molecular FormulaC14H15NO2S2
Molecular Weight293.41 g/mol
Exact Mass293.05
IUPAC NameN-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide
SMILESC=CCN(c1ccccc1C)S(=O)(=O)c1cccs1
InChIInChI=1S/C14H15NO2S2/c1-3-10-15(13-8-5-4-7-12(13)2)19(16,17)14-9-6-11-18-14/h3-9,11H,1,10H2,2H3
InChIKeySAJGXCSXQQIXAN-UHFFFAOYSA-N
XLogP3.44
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

methyl 2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]benzoate
CID 100548313
N-(4-methoxyphenyl)-N-prop-2-enylthiophene-2-sulfonamide
CID 100548025
N-(4-propan-2-ylphenyl)-N-prop-2-enylthiophene-2-sulfonamide
CID 100547585
N-prop-2-enyl-N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
CID 100551054
methyl 4-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]benzoate
CID 100548946
N-(2-chloro-5-nitrophenyl)-N-prop-2-enylthiophene-2-sulfonamide
CID 100552462
N-(3-chloro-4-methoxyphenyl)-N-prop-2-enylthiophene-2-sulfonamide
CID 100549879
N-(2-aminophenyl)-N-ethylthiophene-2-sulfonamide
CID 62102311
N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide
CID 100550599
N-ethyl-N-naphthalen-1-yl-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 31472011
N-(2,3-dimethylphenyl)-N-prop-2-enylnaphthalene-2-sulfonamide
CID 100532351
N-[(4-cyanophenyl)methyl]-N-(2-methoxyphenyl)thiophene-2-sulfonamide
CID 2089335

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide?
The IUPAC name of N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide (CID 100547015) is N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide.
What is the SMILES notation for N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide?
The canonical SMILES for N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide is C=CCN(c1ccccc1C)S(=O)(=O)c1cccs1.
What is the InChIKey of N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide?
The InChIKey is SAJGXCSXQQIXAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S2/c1-3-10-15(13-8-5-4-7-12(13)2)19(16,17)14-9-6-11-18-14/h3-9,11H,1,10H2,2H3.
What are the key properties of N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide?
N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide has a molecular weight of 293.41 g/mol, XLogP of 3.44, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide is sourced from PubChem (CID 100547015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).