N,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide

C15H20N4O2S2 — CID 110093251

IUPACN,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCCC(c2ccc(-c3nccs3)cn2)C1
InChIInChI=1S/C15H20N4O2S2/c1-18(2)23(20,21)19-8-3-4-13(11-19)14-6-5-12(10-17-14)15-16-7-9-22-15/h5-7,9-10,13H,3-4,8,11H2,1-2H3
InChIKeyINAJWBUGSGGRCX-UHFFFAOYSA-N
MW352.49 g/mol
LogP2.19
Rot. Bonds4

About N,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide

N,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide (PubChem CID 110093251) has the molecular formula C15H20N4O2S2 and a molecular weight of 352.49 g/mol. Its IUPAC name is N,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide
PubChem CID110093251
Molecular FormulaC15H20N4O2S2
Molecular Weight352.49 g/mol
Exact Mass352.10
IUPAC NameN,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCCC(c2ccc(-c3nccs3)cn2)C1
InChIInChI=1S/C15H20N4O2S2/c1-18(2)23(20,21)19-8-3-4-13(11-19)14-6-5-12(10-17-14)15-16-7-9-22-15/h5-7,9-10,13H,3-4,8,11H2,1-2H3
InChIKeyINAJWBUGSGGRCX-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-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide?
The IUPAC name of N,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide (CID 110093251) is N,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide.
What is the SMILES notation for N,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide?
The canonical SMILES for N,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide is CN(C)S(=O)(=O)N1CCCC(c2ccc(-c3nccs3)cn2)C1.
What is the InChIKey of N,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide?
The InChIKey is INAJWBUGSGGRCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2S2/c1-18(2)23(20,21)19-8-3-4-13(11-19)14-6-5-12(10-17-14)15-16-7-9-22-15/h5-7,9-10,13H,3-4,8,11H2,1-2H3.
What are the key properties of N,N-dimethyl-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide?
N,N-dimethyl-3-[5-(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-3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]piperidine-1-sulfonamide is sourced from PubChem (CID 110093251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).