N-butyl-N-methylthiophene-2-sulfonamide

C9H15NO2S2 — CID 4992196

IUPACN-butyl-N-methylthiophene-2-sulfonamide
SMILESCCCCN(C)S(=O)(=O)c1cccs1
InChIInChI=1S/C9H15NO2S2/c1-3-4-7-10(2)14(11,12)9-6-5-8-13-9/h5-6,8H,3-4,7H2,1-2H3
InChIKeyXTAKHKTUPFHHKD-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.17
Rot. Bonds5

About N-butyl-N-methylthiophene-2-sulfonamide

N-butyl-N-methylthiophene-2-sulfonamide (PubChem CID 4992196) has the molecular formula C9H15NO2S2 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-butyl-N-methylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-butyl-N-methylthiophene-2-sulfonamide
PubChem CID4992196
Molecular FormulaC9H15NO2S2
Molecular Weight233.36 g/mol
Exact Mass233.05
IUPAC NameN-butyl-N-methylthiophene-2-sulfonamide
SMILESCCCCN(C)S(=O)(=O)c1cccs1
InChIInChI=1S/C9H15NO2S2/c1-3-4-7-10(2)14(11,12)9-6-5-8-13-9/h5-6,8H,3-4,7H2,1-2H3
InChIKeyXTAKHKTUPFHHKD-UHFFFAOYSA-N
XLogP2.17
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-methylthiophene-2-sulfonamide;hydrochloride
CID 130616398
N-[3-(4-fluorophenoxy)propyl]-N-methylthiophene-2-sulfonamide
CID 39967068
2-[methyl(thiophen-2-ylsulfonyl)amino]-N-pentylacetamide
CID 18108266
N-butyl-N-(1H-pyrrol-2-yl)thiophene-2-sulfonamide
CID 132507890
N-(2-chloropropyl)-N-methylthiophene-2-sulfonamide
CID 63397170
1,3-diethyl-2-[2-[methyl(thiophen-2-ylsulfonyl)amino]ethyl]guanidine;hydroiodide
CID 86780372
N-[2-(2-methylpropanoylamino)ethyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide
CID 24666466
methyl 2-[methyl(thiophen-2-ylsulfonyl)amino]acetate
CID 3312195
N-methyl-N-(pyridin-4-ylmethyl)thiophene-2-sulfonamide
CID 47020933
ethyl 2-[methyl(thiophen-2-ylsulfonyl)amino]acetate
CID 55028782
4-[methyl(thiophen-2-ylsulfonyl)amino]-N-(pyridin-4-ylmethyl)butanamide
CID 18136265
N-[(2R)-2-cyanopropyl]-N-ethyl-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide
CID 94649725

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-methylthiophene-2-sulfonamide?
The IUPAC name of N-butyl-N-methylthiophene-2-sulfonamide (CID 4992196) is N-butyl-N-methylthiophene-2-sulfonamide.
What is the SMILES notation for N-butyl-N-methylthiophene-2-sulfonamide?
The canonical SMILES for N-butyl-N-methylthiophene-2-sulfonamide is CCCCN(C)S(=O)(=O)c1cccs1.
What is the InChIKey of N-butyl-N-methylthiophene-2-sulfonamide?
The InChIKey is XTAKHKTUPFHHKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2S2/c1-3-4-7-10(2)14(11,12)9-6-5-8-13-9/h5-6,8H,3-4,7H2,1-2H3.
What are the key properties of N-butyl-N-methylthiophene-2-sulfonamide?
N-butyl-N-methylthiophene-2-sulfonamide has a molecular weight of 233.36 g/mol, XLogP of 2.17, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-methylthiophene-2-sulfonamide is sourced from PubChem (CID 4992196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).