5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine

C7H11N3O2S2 — CID 28505346

IUPAC5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
SMILESCS(=O)(=O)N1CCc2nc(N)sc2C1
InChIInChI=1S/C7H11N3O2S2/c1-14(11,12)10-3-2-5-6(4-10)13-7(8)9-5/h2-4H2,1H3,(H2,8,9)
InChIKeyBGOVVFUFMMDRRC-UHFFFAOYSA-N
MW233.32 g/mol
LogP0.04
Rot. Bonds1

About 5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine

5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine (PubChem CID 28505346) has the molecular formula C7H11N3O2S2 and a molecular weight of 233.32 g/mol. Its IUPAC name is 5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine.

Molecular Properties

Compound Name5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
PubChem CID28505346
Molecular FormulaC7H11N3O2S2
Molecular Weight233.32 g/mol
Exact Mass233.03
IUPAC Name5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
SMILESCS(=O)(=O)N1CCc2nc(N)sc2C1
InChIInChI=1S/C7H11N3O2S2/c1-14(11,12)10-3-2-5-6(4-10)13-7(8)9-5/h2-4H2,1H3,(H2,8,9)
InChIKeyBGOVVFUFMMDRRC-UHFFFAOYSA-N
XLogP0.04
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The IUPAC name of 5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine (CID 28505346) is 5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine.
What is the SMILES notation for 5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The canonical SMILES for 5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine is CS(=O)(=O)N1CCc2nc(N)sc2C1.
What is the InChIKey of 5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The InChIKey is BGOVVFUFMMDRRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2S2/c1-14(11,12)10-3-2-5-6(4-10)13-7(8)9-5/h2-4H2,1H3,(H2,8,9).
What are the key properties of 5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine has a molecular weight of 233.32 g/mol, XLogP of 0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylsulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine is sourced from PubChem (CID 28505346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).