6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole

C9H14N4O2S2 — CID 5310188

IUPAC6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole
SMILESCc1csc2nc(CNS(=O)(=O)N(C)C)cn12
InChIInChI=1S/C9H14N4O2S2/c1-7-6-16-9-11-8(5-13(7)9)4-10-17(14,15)12(2)3/h5-6,10H,4H2,1-3H3
InChIKeyPNHGLQDPJHKMBN-UHFFFAOYSA-N
MW274.37 g/mol
LogP0.60
Rot. Bonds4

About 6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole

6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole (PubChem CID 5310188) has the molecular formula C9H14N4O2S2 and a molecular weight of 274.37 g/mol. Its IUPAC name is 6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole
PubChem CID5310188
Molecular FormulaC9H14N4O2S2
Molecular Weight274.37 g/mol
Exact Mass274.06
IUPAC Name6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole
SMILESCc1csc2nc(CNS(=O)(=O)N(C)C)cn12
InChIInChI=1S/C9H14N4O2S2/c1-7-6-16-9-11-8(5-13(7)9)4-10-17(14,15)12(2)3/h5-6,10H,4H2,1-3H3
InChIKeyPNHGLQDPJHKMBN-UHFFFAOYSA-N
XLogP0.60
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole (CID 5310188) is 6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole is Cc1csc2nc(CNS(=O)(=O)N(C)C)cn12.
What is the InChIKey of 6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole?
The InChIKey is PNHGLQDPJHKMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2S2/c1-7-6-16-9-11-8(5-13(7)9)4-10-17(14,15)12(2)3/h5-6,10H,4H2,1-3H3.
What are the key properties of 6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole?
6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole has a molecular weight of 274.37 g/mol, XLogP of 0.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(dimethylsulfamoylamino)methyl]-3-methylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 5310188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).