ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide

C10H19N3O2S2 — CID 90828299

IUPACethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide
SMILESCC.CN(c1c2c(nn1C)CSC2)S(C)(=O)=O
InChIInChI=1S/C8H13N3O2S2.C2H6/c1-10-8(11(2)15(3,12)13)6-4-14-5-7(6)9-10;1-2/h4-5H2,1-3H3;1-2H3
InChIKeyBJZCGRZOHDPDAK-UHFFFAOYSA-N
MW277.41 g/mol
LogP1.59
Rot. Bonds2

About ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide

ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide (PubChem CID 90828299) has the molecular formula C10H19N3O2S2 and a molecular weight of 277.41 g/mol. Its IUPAC name is ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide.

Molecular Properties

Compound Nameethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide
PubChem CID90828299
Molecular FormulaC10H19N3O2S2
Molecular Weight277.41 g/mol
Exact Mass277.09
IUPAC Nameethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide
SMILESCC.CN(c1c2c(nn1C)CSC2)S(C)(=O)=O
InChIInChI=1S/C8H13N3O2S2.C2H6/c1-10-8(11(2)15(3,12)13)6-4-14-5-7(6)9-10;1-2/h4-5H2,1-3H3;1-2H3
InChIKeyBJZCGRZOHDPDAK-UHFFFAOYSA-N
XLogP1.59
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide?
The IUPAC name of ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide (CID 90828299) is ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide.
What is the SMILES notation for ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide?
The canonical SMILES for ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide is CC.CN(c1c2c(nn1C)CSC2)S(C)(=O)=O.
What is the InChIKey of ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide?
The InChIKey is BJZCGRZOHDPDAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2S2.C2H6/c1-10-8(11(2)15(3,12)13)6-4-14-5-7(6)9-10;1-2/h4-5H2,1-3H3;1-2H3.
What are the key properties of ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide?
ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide has a molecular weight of 277.41 g/mol, XLogP of 1.59, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide is sourced from PubChem (CID 90828299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).