3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide

C11H20N4O2S2 — CID 103359084

IUPAC3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide
SMILESCC1CN(c2snc(N)c2S(=O)(=O)N(C)C)CC1C
InChIInChI=1S/C11H20N4O2S2/c1-7-5-15(6-8(7)2)11-9(10(12)13-18-11)19(16,17)14(3)4/h7-8H,5-6H2,1-4H3,(H2,12,13)
InChIKeyRSOPGSMYFUFUIO-UHFFFAOYSA-N
MW304.44 g/mol
LogP1.07
Rot. Bonds3

About 3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide

3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide (PubChem CID 103359084) has the molecular formula C11H20N4O2S2 and a molecular weight of 304.44 g/mol. Its IUPAC name is 3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide.

Molecular Properties

Compound Name3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide
PubChem CID103359084
Molecular FormulaC11H20N4O2S2
Molecular Weight304.44 g/mol
Exact Mass304.10
IUPAC Name3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide
SMILESCC1CN(c2snc(N)c2S(=O)(=O)N(C)C)CC1C
InChIInChI=1S/C11H20N4O2S2/c1-7-5-15(6-8(7)2)11-9(10(12)13-18-11)19(16,17)14(3)4/h7-8H,5-6H2,1-4H3,(H2,12,13)
InChIKeyRSOPGSMYFUFUIO-UHFFFAOYSA-N
XLogP1.07
TPSA79.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

3-amino-N,N-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]-1,2-thiazole-4-sulfonamide
CID 103360593
3-amino-5-[ethyl(2,2,2-trifluoroethyl)amino]-N,N-dimethyl-1,2-thiazole-4-sulfonamide
CID 103360704
3-amino-N,N-dimethyl-5-[propyl(2,2,2-trifluoroethyl)amino]-1,2-thiazole-4-sulfonamide
CID 103360724
3-amino-N,N-dimethyl-5-[methyl(3,3,3-trifluoropropyl)amino]-1,2-thiazole-4-sulfonamide
CID 103363219
3-amino-5-[2,2-difluoroethyl(methyl)amino]-N,N-dimethyl-1,2-thiazole-4-sulfonamide
CID 103365689
4-Cyclopropylsulfonyl-5-(3,4-dimethylpyrrolidin-1-yl)-1,2-thiazol-3-amine
CID 103348825
4-cyclopropylsulfonyl-5-N-methyl-5-N-(3-methylbutyl)-1,2-thiazole-3,5-diamine
CID 103349241
4-cyclopropylsulfonyl-5-N-methyl-5-N-(2-methylbutyl)-1,2-thiazole-3,5-diamine
CID 103349372
4-cyclopropylsulfonyl-5-N-methyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-1,2-thiazole-3,5-diamine
CID 103349406
4-cyclopropylsulfonyl-5-N-[(1-ethylpyrrolidin-3-yl)methyl]-1,2-thiazole-3,5-diamine
CID 103349610
4-cyclopropylsulfonyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-1,2-thiazole-3,5-diamine
CID 103349612
4-cyclopropylsulfonyl-5-N-ethyl-5-N-(2-methylbutyl)-1,2-thiazole-3,5-diamine
CID 103349646

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide?
The IUPAC name of 3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide (CID 103359084) is 3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide.
What is the SMILES notation for 3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide?
The canonical SMILES for 3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide is CC1CN(c2snc(N)c2S(=O)(=O)N(C)C)CC1C.
What is the InChIKey of 3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide?
The InChIKey is RSOPGSMYFUFUIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2S2/c1-7-5-15(6-8(7)2)11-9(10(12)13-18-11)19(16,17)14(3)4/h7-8H,5-6H2,1-4H3,(H2,12,13).
What are the key properties of 3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide?
3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide has a molecular weight of 304.44 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-(3,4-dimethylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide is sourced from PubChem (CID 103359084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).