4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole

C7H14N4O2S2 — CID 110719604

IUPAC4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole
SMILESCNc1nc(CNS(=O)(=O)N(C)C)cs1
InChIInChI=1S/C7H14N4O2S2/c1-8-7-10-6(5-14-7)4-9-15(12,13)11(2)3/h5,9H,4H2,1-3H3,(H,8,10)
InChIKeyLSPZHHQACUNTPM-UHFFFAOYSA-N
MW250.35 g/mol
LogP0.08
Rot. Bonds5

About 4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole

4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole (PubChem CID 110719604) has the molecular formula C7H14N4O2S2 and a molecular weight of 250.35 g/mol. Its IUPAC name is 4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole.

Molecular Properties

Compound Name4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole
PubChem CID110719604
Molecular FormulaC7H14N4O2S2
Molecular Weight250.35 g/mol
Exact Mass250.06
IUPAC Name4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole
SMILESCNc1nc(CNS(=O)(=O)N(C)C)cs1
InChIInChI=1S/C7H14N4O2S2/c1-8-7-10-6(5-14-7)4-9-15(12,13)11(2)3/h5,9H,4H2,1-3H3,(H,8,10)
InChIKeyLSPZHHQACUNTPM-UHFFFAOYSA-N
XLogP0.08
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-N-[[2-(methylamino)-1,3-thiazol-4-yl]methyl]thiophene-2-sulfonamide
CID 110719630
1-(4-fluorophenyl)-N-[[2-(methylamino)-1,3-thiazol-4-yl]methyl]methanesulfonamide
CID 110719640
N-methyl-4-[(propan-2-ylamino)methyl]-1,3-thiazol-2-amine
CID 130632484
4-fluoro-2-methyl-N-[[2-(methylamino)-1,3-thiazol-4-yl]methyl]benzenesulfonamide
CID 110719618
N-[[2-(methylamino)-1,3-thiazol-4-yl]methyl]-3-phenylpropane-1-sulfonamide
CID 110719646
ethyl N-[[2-(methylamino)-1,3-thiazol-4-yl]methyl]carbamate
CID 110719565
3-[(dimethylsulfamoylamino)methyl]-5-methyl-1,2-oxazole
CID 47405494
N-[2-[2-(methylamino)-1,3-thiazol-4-yl]ethyl]-1-phenylmethanesulfonamide
CID 110397975
4-methyl-N-[2-[2-(methylamino)-1,3-thiazol-4-yl]ethyl]benzenesulfonamide
CID 110397943
N-methyl-4-(2-methylpropyl)-1,3-thiazol-2-amine
CID 59665191
N-butyl-N-methyl-2-[2-(methylamino)-1,3-thiazol-4-yl]acetamide
CID 110386244
1-cyclopentyl-3-[[2-(methylamino)-1,3-thiazol-4-yl]methyl]urea
CID 110747915

Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole?
The IUPAC name of 4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole (CID 110719604) is 4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole.
What is the SMILES notation for 4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole?
The canonical SMILES for 4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole is CNc1nc(CNS(=O)(=O)N(C)C)cs1.
What is the InChIKey of 4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole?
The InChIKey is LSPZHHQACUNTPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4O2S2/c1-8-7-10-6(5-14-7)4-9-15(12,13)11(2)3/h5,9H,4H2,1-3H3,(H,8,10).
What are the key properties of 4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole?
4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole has a molecular weight of 250.35 g/mol, XLogP of 0.08, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylsulfamoylamino)methyl]-2-(methylamino)-1,3-thiazole is sourced from PubChem (CID 110719604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).