2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene

C8H14N2O2S2 — CID 35609525

IUPAC2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene
SMILESCc1ccsc1CNS(=O)(=O)N(C)C
InChIInChI=1S/C8H14N2O2S2/c1-7-4-5-13-8(7)6-9-14(11,12)10(2)3/h4-5,9H,6H2,1-3H3
InChIKeyZUSIKGAZGARGJQ-UHFFFAOYSA-N
MW234.35 g/mol
LogP0.95
Rot. Bonds4

About 2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene

2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene (PubChem CID 35609525) has the molecular formula C8H14N2O2S2 and a molecular weight of 234.35 g/mol. Its IUPAC name is 2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene.

Molecular Properties

Compound Name2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene
PubChem CID35609525
Molecular FormulaC8H14N2O2S2
Molecular Weight234.35 g/mol
Exact Mass234.05
IUPAC Name2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene
SMILESCc1ccsc1CNS(=O)(=O)N(C)C
InChIInChI=1S/C8H14N2O2S2/c1-7-4-5-13-8(7)6-9-14(11,12)10(2)3/h4-5,9H,6H2,1-3H3
InChIKeyZUSIKGAZGARGJQ-UHFFFAOYSA-N
XLogP0.95
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene?
The IUPAC name of 2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene (CID 35609525) is 2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene.
What is the SMILES notation for 2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene?
The canonical SMILES for 2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene is Cc1ccsc1CNS(=O)(=O)N(C)C.
What is the InChIKey of 2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene?
The InChIKey is ZUSIKGAZGARGJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2S2/c1-7-4-5-13-8(7)6-9-14(11,12)10(2)3/h4-5,9H,6H2,1-3H3.
What are the key properties of 2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene?
2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene has a molecular weight of 234.35 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(dimethylsulfamoylamino)methyl]-3-methylthiophene is sourced from PubChem (CID 35609525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).