5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine

C11H19N3O3S2 — CID 107393489

IUPAC5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine
SMILESCOC1(C)CCCN(S(=O)(=O)c2sc(N)nc2C)C1
InChIInChI=1S/C11H19N3O3S2/c1-8-9(18-10(12)13-8)19(15,16)14-6-4-5-11(2,7-14)17-3/h4-7H2,1-3H3,(H2,12,13)
InChIKeyFSLMEHMOCQWOOW-UHFFFAOYSA-N
MW305.43 g/mol
LogP1.22
Rot. Bonds3

About 5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine

5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine (PubChem CID 107393489) has the molecular formula C11H19N3O3S2 and a molecular weight of 305.43 g/mol. Its IUPAC name is 5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine
PubChem CID107393489
Molecular FormulaC11H19N3O3S2
Molecular Weight305.43 g/mol
Exact Mass305.09
IUPAC Name5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine
SMILESCOC1(C)CCCN(S(=O)(=O)c2sc(N)nc2C)C1
InChIInChI=1S/C11H19N3O3S2/c1-8-9(18-10(12)13-8)19(15,16)14-6-4-5-11(2,7-14)17-3/h4-7H2,1-3H3,(H2,12,13)
InChIKeyFSLMEHMOCQWOOW-UHFFFAOYSA-N
XLogP1.22
TPSA85.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[(2-amino-4-methyl-1,3-thiazol-5-yl)sulfonyl]-4-methylazepan-4-ol
CID 107405200
4-methyl-5-(1,4-thiazepan-4-ylsulfonyl)-1,3-thiazol-2-amine
CID 63946602
5-(4-methoxypiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine
CID 63945987
5-[3-(methoxymethyl)piperidin-1-yl]sulfonyl-4-methyl-1,3-thiazol-2-amine
CID 106587611
3,5-difluoro-4-(3-methoxy-3-methylpiperidin-1-yl)sulfonylaniline
CID 107390370
4-methyl-5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]-1,3-thiazol-2-amine
CID 63947423
methyl 5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-1,3-thiazole-4-carboxylate
CID 107390968
2-methoxy-4-(3-methoxy-3-methylpiperidin-1-yl)sulfonylaniline
CID 107390440
3-methoxy-4-(3-methoxy-3-methylpiperidin-1-yl)sulfonylaniline
CID 107390417
2-(3-methoxy-3-methylpiperidin-1-yl)sulfonylpropan-1-amine
CID 107392208
5-bromo-4-(3-methoxy-3-methylpiperidin-1-yl)sulfonylthiophene-2-carboxylic acid
CID 107390938
[4-(3-methoxy-3-methylpiperidin-1-yl)sulfonylthiophen-2-yl]methanol
CID 107396073

Frequently Asked Questions

What is the IUPAC name of 5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine (CID 107393489) is 5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine is COC1(C)CCCN(S(=O)(=O)c2sc(N)nc2C)C1.
What is the InChIKey of 5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine?
The InChIKey is FSLMEHMOCQWOOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3S2/c1-8-9(18-10(12)13-8)19(15,16)14-6-4-5-11(2,7-14)17-3/h4-7H2,1-3H3,(H2,12,13).
What are the key properties of 5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine?
5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine has a molecular weight of 305.43 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methoxy-3-methylpiperidin-1-yl)sulfonyl-4-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 107393489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).