1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide

C10H16N4O3S2 — CID 103381033

IUPAC1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide
SMILESCS(=O)(=O)c1c(N)nsc1N1CCCC(C(N)=O)C1
InChIInChI=1S/C10H16N4O3S2/c1-19(16,17)7-8(11)13-18-10(7)14-4-2-3-6(5-14)9(12)15/h6H,2-5H2,1H3,(H2,11,13)(H2,12,15)
InChIKeyHGTIMNYDGFJTDD-UHFFFAOYSA-N
MW304.40 g/mol
LogP-0.17
Rot. Bonds3

About 1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide

1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide (PubChem CID 103381033) has the molecular formula C10H16N4O3S2 and a molecular weight of 304.40 g/mol. Its IUPAC name is 1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide
PubChem CID103381033
Molecular FormulaC10H16N4O3S2
Molecular Weight304.40 g/mol
Exact Mass304.07
IUPAC Name1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide
SMILESCS(=O)(=O)c1c(N)nsc1N1CCCC(C(N)=O)C1
InChIInChI=1S/C10H16N4O3S2/c1-19(16,17)7-8(11)13-18-10(7)14-4-2-3-6(5-14)9(12)15/h6H,2-5H2,1H3,(H2,11,13)(H2,12,15)
InChIKeyHGTIMNYDGFJTDD-UHFFFAOYSA-N
XLogP-0.17
TPSA119.38 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

1-(3-amino-4-cyclopropylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide
CID 103349281
4-methylsulfonyl-5-(3-piperidin-1-ylpyrrolidin-1-yl)-1,2-thiazol-3-amine
CID 103381800
N-[1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)pyrrolidin-3-yl]acetamide
CID 103384147
4-methylsulfonyl-5-(4-propan-2-ylazepan-1-yl)-1,2-thiazol-3-amine
CID 103382069
1-[3-amino-4-(2-methyl-1,3-thiazol-4-yl)-1,2-thiazol-5-yl]piperidine-3-carboxamide
CID 103381037
5-(4,4-dimethylpiperidin-1-yl)-4-methylsulfonyl-1,2-thiazol-3-amine
CID 103381662
5-(2,6-dimethylthiomorpholin-4-yl)-4-methylsulfonyl-1,2-thiazol-3-amine
CID 103382034
5-(4-tert-butylpiperidin-1-yl)-4-methylsulfonyl-1,2-thiazol-3-amine
CID 103379610
4-methylsulfonyl-5-(1,4-oxazepan-4-yl)-1,2-thiazol-3-amine
CID 103381681
4-ethylsulfonyl-5-(3-methylpiperidin-1-yl)-1,2-thiazol-3-amine
CID 103362141
5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-4-methylsulfonyl-1,2-thiazol-3-amine
CID 103382138
4-methylsulfonyl-5-(4-propylpiperidin-1-yl)-1,2-thiazol-3-amine
CID 103380926

Frequently Asked Questions

What is the IUPAC name of 1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide?
The IUPAC name of 1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide (CID 103381033) is 1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide?
The canonical SMILES for 1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide is CS(=O)(=O)c1c(N)nsc1N1CCCC(C(N)=O)C1.
What is the InChIKey of 1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide?
The InChIKey is HGTIMNYDGFJTDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3S2/c1-19(16,17)7-8(11)13-18-10(7)14-4-2-3-6(5-14)9(12)15/h6H,2-5H2,1H3,(H2,11,13)(H2,12,15).
What are the key properties of 1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide?
1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide has a molecular weight of 304.40 g/mol, XLogP of -0.17, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide is sourced from PubChem (CID 103381033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).