N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide

C16H17N3O4S — CID 53498937

IUPACN,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide
SMILESCc1nc2ccccc2n(Cc2ccc(S(=O)(=O)N(C)C)o2)c1=O
InChIInChI=1S/C16H17N3O4S/c1-11-16(20)19(14-7-5-4-6-13(14)17-11)10-12-8-9-15(23-12)24(21,22)18(2)3/h4-9H,10H2,1-3H3
InChIKeyORDFUXBKLGDTIB-UHFFFAOYSA-N
MW347.40 g/mol
LogP1.60
Rot. Bonds4

About N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide

N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide (PubChem CID 53498937) has the molecular formula C16H17N3O4S and a molecular weight of 347.40 g/mol. Its IUPAC name is N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide
PubChem CID53498937
Molecular FormulaC16H17N3O4S
Molecular Weight347.40 g/mol
Exact Mass347.09
IUPAC NameN,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide
SMILESCc1nc2ccccc2n(Cc2ccc(S(=O)(=O)N(C)C)o2)c1=O
InChIInChI=1S/C16H17N3O4S/c1-11-16(20)19(14-7-5-4-6-13(14)17-11)10-12-8-9-15(23-12)24(21,22)18(2)3/h4-9H,10H2,1-3H3
InChIKeyORDFUXBKLGDTIB-UHFFFAOYSA-N
XLogP1.60
TPSA85.41 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.40
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-benzyl-3-methylquinoxalin-2-one
CID 139051924
3-methyl-1-[(4-methylphenyl)methyl]quinoxalin-2-one
CID 13170889
1-ethyl-3-methylquinoxalin-2-one
CID 139075519
3-methyl-1-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]quinoxalin-2-one
CID 72940907
1-[(2-chloro-1,3-thiazol-5-yl)methyl]-3-methylquinoxalin-2-one
CID 79765497
1-[(4-bromothiophen-2-yl)methyl]-3-methylquinoxalin-2-one
CID 62375019
5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]-1,2-oxazole-3-carboxylic acid
CID 62374387
3-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-carboxylic acid
CID 62374530
1-hexadecyl-3-methylquinoxalin-2-one
CID 57358117
1-(2,2-dimethoxyethyl)-3-methylquinoxalin-2-one
CID 66221507
3-(3-methyl-2-oxoquinoxalin-1-yl)propanoic acid
CID 62374383
2-(3-methyl-2-oxoquinoxalin-1-yl)ethanethioamide
CID 62374548

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide?
The IUPAC name of N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide (CID 53498937) is N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide.
What is the SMILES notation for N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide?
The canonical SMILES for N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide is Cc1nc2ccccc2n(Cc2ccc(S(=O)(=O)N(C)C)o2)c1=O.
What is the InChIKey of N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide?
The InChIKey is ORDFUXBKLGDTIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O4S/c1-11-16(20)19(14-7-5-4-6-13(14)17-11)10-12-8-9-15(23-12)24(21,22)18(2)3/h4-9H,10H2,1-3H3.
What are the key properties of N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide?
N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide has a molecular weight of 347.40 g/mol, XLogP of 1.60, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-[(3-methyl-2-oxoquinoxalin-1-yl)methyl]furan-2-sulfonamide is sourced from PubChem (CID 53498937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).