9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide

C15H20N4O4S — CID 67793888

IUPAC9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide
SMILESCCN1CCc2ccc3[nH]c(=O)c(=O)n(S(=O)(=O)N(C)C)c3c2C1
InChIInChI=1S/C15H20N4O4S/c1-4-18-8-7-10-5-6-12-13(11(10)9-18)19(15(21)14(20)16-12)24(22,23)17(2)3/h5-6H,4,7-9H2,1-3H3,(H,16,20)
InChIKeySCOLDLWOHBGHFU-UHFFFAOYSA-N
MW352.42 g/mol
LogP-0.28
Rot. Bonds3

About 9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide

9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide (PubChem CID 67793888) has the molecular formula C15H20N4O4S and a molecular weight of 352.42 g/mol. Its IUPAC name is 9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide.

Molecular Properties

Compound Name9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide
PubChem CID67793888
Molecular FormulaC15H20N4O4S
Molecular Weight352.42 g/mol
Exact Mass352.12
IUPAC Name9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide
SMILESCCN1CCc2ccc3[nH]c(=O)c(=O)n(S(=O)(=O)N(C)C)c3c2C1
InChIInChI=1S/C15H20N4O4S/c1-4-18-8-7-10-5-6-12-13(11(10)9-18)19(15(21)14(20)16-12)24(22,23)17(2)3/h5-6H,4,7-9H2,1-3H3,(H,16,20)
InChIKeySCOLDLWOHBGHFU-UHFFFAOYSA-N
XLogP-0.28
TPSA95.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.42
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide?
The IUPAC name of 9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide (CID 67793888) is 9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide.
What is the SMILES notation for 9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide?
The canonical SMILES for 9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide is CCN1CCc2ccc3[nH]c(=O)c(=O)n(S(=O)(=O)N(C)C)c3c2C1.
What is the InChIKey of 9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide?
The InChIKey is SCOLDLWOHBGHFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O4S/c1-4-18-8-7-10-5-6-12-13(11(10)9-18)19(15(21)14(20)16-12)24(22,23)17(2)3/h5-6H,4,7-9H2,1-3H3,(H,16,20).
What are the key properties of 9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide?
9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide has a molecular weight of 352.42 g/mol, XLogP of -0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-N,N-dimethyl-2,3-dioxo-4,7,8,10-tetrahydropyrido[4,3-h]quinoxaline-1-sulfonamide is sourced from PubChem (CID 67793888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).