N,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide

C15H20N4O3S — CID 90560109

IUPACN,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC(Oc2cnc3ccccc3n2)CC1
InChIInChI=1S/C15H20N4O3S/c1-18(2)23(20,21)19-9-7-12(8-10-19)22-15-11-16-13-5-3-4-6-14(13)17-15/h3-6,11-12H,7-10H2,1-2H3
InChIKeyHQEFONYBODUSND-UHFFFAOYSA-N
MW336.42 g/mol
LogP1.28
Rot. Bonds4

About N,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide

N,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide (PubChem CID 90560109) has the molecular formula C15H20N4O3S and a molecular weight of 336.42 g/mol. Its IUPAC name is N,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide
PubChem CID90560109
Molecular FormulaC15H20N4O3S
Molecular Weight336.42 g/mol
Exact Mass336.13
IUPAC NameN,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC(Oc2cnc3ccccc3n2)CC1
InChIInChI=1S/C15H20N4O3S/c1-18(2)23(20,21)19-9-7-12(8-10-19)22-15-11-16-13-5-3-4-6-14(13)17-15/h3-6,11-12H,7-10H2,1-2H3
InChIKeyHQEFONYBODUSND-UHFFFAOYSA-N
XLogP1.28
TPSA75.63 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.42
LogP ≤ 51.28
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-quinoxalin-2-yloxypiperidine-1-sulfonamide?
The IUPAC name of N,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide (CID 90560109) is N,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide.
What is the SMILES notation for N,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide?
The canonical SMILES for N,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide is CN(C)S(=O)(=O)N1CCC(Oc2cnc3ccccc3n2)CC1.
What is the InChIKey of N,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide?
The InChIKey is HQEFONYBODUSND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3S/c1-18(2)23(20,21)19-9-7-12(8-10-19)22-15-11-16-13-5-3-4-6-14(13)17-15/h3-6,11-12H,7-10H2,1-2H3.
What are the key properties of N,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide?
N,N-dimethyl-4-quinoxalin-2-yloxypiperidine-1-sulfonamide has a molecular weight of 336.42 g/mol, XLogP of 1.28, 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-quinoxalin-2-yloxypiperidine-1-sulfonamide is sourced from PubChem (CID 90560109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).