N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide

C15H20N4O2S2 — CID 110094765

IUPACN,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC(c2cccc(-c3nccs3)n2)CC1
InChIInChI=1S/C15H20N4O2S2/c1-18(2)23(20,21)19-9-6-12(7-10-19)13-4-3-5-14(17-13)15-16-8-11-22-15/h3-5,8,11-12H,6-7,9-10H2,1-2H3
InChIKeyROPFKGBRTGHIJH-UHFFFAOYSA-N
MW352.49 g/mol
LogP2.19
Rot. Bonds4

About N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide

N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide (PubChem CID 110094765) has the molecular formula C15H20N4O2S2 and a molecular weight of 352.49 g/mol. Its IUPAC name is N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide
PubChem CID110094765
Molecular FormulaC15H20N4O2S2
Molecular Weight352.49 g/mol
Exact Mass352.10
IUPAC NameN,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC(c2cccc(-c3nccs3)n2)CC1
InChIInChI=1S/C15H20N4O2S2/c1-18(2)23(20,21)19-9-6-12(7-10-19)13-4-3-5-14(17-13)15-16-8-11-22-15/h3-5,8,11-12H,6-7,9-10H2,1-2H3
InChIKeyROPFKGBRTGHIJH-UHFFFAOYSA-N
XLogP2.19
TPSA66.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.49
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide?
The IUPAC name of N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide (CID 110094765) is N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide.
What is the SMILES notation for N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide?
The canonical SMILES for N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide is CN(C)S(=O)(=O)N1CCC(c2cccc(-c3nccs3)n2)CC1.
What is the InChIKey of N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide?
The InChIKey is ROPFKGBRTGHIJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2S2/c1-18(2)23(20,21)19-9-6-12(7-10-19)13-4-3-5-14(17-13)15-16-8-11-22-15/h3-5,8,11-12H,6-7,9-10H2,1-2H3.
What are the key properties of N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide?
N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide has a molecular weight of 352.49 g/mol, XLogP of 2.19, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[6-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide is sourced from PubChem (CID 110094765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).