N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide

C11H18N4O2S2 — CID 43593466

IUPACN-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide
SMILESO=S(=O)(Nc1nc2c(s1)CNCC2)N1CCCCC1
InChIInChI=1S/C11H18N4O2S2/c16-19(17,15-6-2-1-3-7-15)14-11-13-9-4-5-12-8-10(9)18-11/h12H,1-8H2,(H,13,14)
InChIKeyKLPRCOPOLCHFHY-UHFFFAOYSA-N
MW302.43 g/mol
LogP0.93
Rot. Bonds3

About N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide

N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide (PubChem CID 43593466) has the molecular formula C11H18N4O2S2 and a molecular weight of 302.43 g/mol. Its IUPAC name is N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide
PubChem CID43593466
Molecular FormulaC11H18N4O2S2
Molecular Weight302.43 g/mol
Exact Mass302.09
IUPAC NameN-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide
SMILESO=S(=O)(Nc1nc2c(s1)CNCC2)N1CCCCC1
InChIInChI=1S/C11H18N4O2S2/c16-19(17,15-6-2-1-3-7-15)14-11-13-9-4-5-12-8-10(9)18-11/h12H,1-8H2,(H,13,14)
InChIKeyKLPRCOPOLCHFHY-UHFFFAOYSA-N
XLogP0.93
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.43
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide?
The IUPAC name of N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide (CID 43593466) is N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide.
What is the SMILES notation for N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide?
The canonical SMILES for N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide is O=S(=O)(Nc1nc2c(s1)CNCC2)N1CCCCC1.
What is the InChIKey of N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide?
The InChIKey is KLPRCOPOLCHFHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2S2/c16-19(17,15-6-2-1-3-7-15)14-11-13-9-4-5-12-8-10(9)18-11/h12H,1-8H2,(H,13,14).
What are the key properties of N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide?
N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide has a molecular weight of 302.43 g/mol, XLogP of 0.93, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-sulfonamide is sourced from PubChem (CID 43593466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).