1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine

C11H19N3O2S2 — CID 119979981

IUPAC1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine
SMILESCNC1CCN(S(=O)(=O)c2sc(C)nc2C)CC1
InChIInChI=1S/C11H19N3O2S2/c1-8-11(17-9(2)13-8)18(15,16)14-6-4-10(12-3)5-7-14/h10,12H,4-7H2,1-3H3
InChIKeyRUUUISNXVDCRCN-UHFFFAOYSA-N
MW289.43 g/mol
LogP1.13
Rot. Bonds3

About 1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine

1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine (PubChem CID 119979981) has the molecular formula C11H19N3O2S2 and a molecular weight of 289.43 g/mol. Its IUPAC name is 1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine
PubChem CID119979981
Molecular FormulaC11H19N3O2S2
Molecular Weight289.43 g/mol
Exact Mass289.09
IUPAC Name1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine
SMILESCNC1CCN(S(=O)(=O)c2sc(C)nc2C)CC1
InChIInChI=1S/C11H19N3O2S2/c1-8-11(17-9(2)13-8)18(15,16)14-6-4-10(12-3)5-7-14/h10,12H,4-7H2,1-3H3
InChIKeyRUUUISNXVDCRCN-UHFFFAOYSA-N
XLogP1.13
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.43
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine 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 1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine?
The IUPAC name of 1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine (CID 119979981) is 1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine.
What is the SMILES notation for 1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine?
The canonical SMILES for 1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine is CNC1CCN(S(=O)(=O)c2sc(C)nc2C)CC1.
What is the InChIKey of 1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine?
The InChIKey is RUUUISNXVDCRCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S2/c1-8-11(17-9(2)13-8)18(15,16)14-6-4-10(12-3)5-7-14/h10,12H,4-7H2,1-3H3.
What are the key properties of 1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine?
1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine has a molecular weight of 289.43 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,4-dimethyl-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidin-4-amine is sourced from PubChem (CID 119979981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).