N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide

C17H20N2O4S2 — CID 55831038

IUPACN-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide
SMILESCC1CN(C(=O)c2cccc(NS(=O)(=O)c3cccs3)c2)C(C)CO1
InChIInChI=1S/C17H20N2O4S2/c1-12-11-23-13(2)10-19(12)17(20)14-5-3-6-15(9-14)18-25(21,22)16-7-4-8-24-16/h3-9,12-13,18H,10-11H2,1-2H3
InChIKeyCRVBCQVIXQHIJB-UHFFFAOYSA-N
MW380.49 g/mol
LogP2.80
Rot. Bonds4

About N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide

N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide (PubChem CID 55831038) has the molecular formula C17H20N2O4S2 and a molecular weight of 380.49 g/mol. Its IUPAC name is N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide
PubChem CID55831038
Molecular FormulaC17H20N2O4S2
Molecular Weight380.49 g/mol
Exact Mass380.09
IUPAC NameN-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide
SMILESCC1CN(C(=O)c2cccc(NS(=O)(=O)c3cccs3)c2)C(C)CO1
InChIInChI=1S/C17H20N2O4S2/c1-12-11-23-13(2)10-19(12)17(20)14-5-3-6-15(9-14)18-25(21,22)16-7-4-8-24-16/h3-9,12-13,18H,10-11H2,1-2H3
InChIKeyCRVBCQVIXQHIJB-UHFFFAOYSA-N
XLogP2.80
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-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

N-[3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)phenyl]thiophene-2-sulfonamide
CID 55794078
(2R)-1-[3-(thiophen-2-ylsulfonylamino)benzoyl]pyrrolidine-2-carboxylic acid
CID 119370582
3-[(2R,5S)-2,5-dimethylmorpholine-4-carbonyl]-N-methylbenzenesulfonamide
CID 94051447
(3-bromophenyl)-(2,5-dimethylmorpholin-4-yl)methanone
CID 43420926
N-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]thiophene-2-sulfonamide
CID 55786880
N-[3-[3-(methylaminomethyl)pyrrolidine-1-carbonyl]phenyl]thiophene-2-sulfonamide;hydrochloride
CID 119540689
N-[3-[4-(thiomorpholine-4-carbonyl)-1,3-thiazolidine-3-carbonyl]phenyl]thiophene-2-sulfonamide
CID 155947417
(2,5-dimethylmorpholin-4-yl)-(3-iodophenyl)methanone
CID 47163087
N-[3-[4-(6-chloro-2-pyridinyl)piperazine-1-carbonyl]phenyl]thiophene-2-sulfonamide
CID 55924296
N-[3-(4-amino-3,3-dimethylpiperidine-1-carbonyl)phenyl]thiophene-2-sulfonamide;hydrochloride
CID 120814349
N-(3-acetylphenyl)-2,5-dimethylmorpholine-4-carboxamide
CID 61345863
(2,5-dimethylmorpholin-4-yl)-[3-(trifluoromethyl)phenyl]methanone
CID 51077388

Frequently Asked Questions

What is the IUPAC name of N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide (CID 55831038) is N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide is CC1CN(C(=O)c2cccc(NS(=O)(=O)c3cccs3)c2)C(C)CO1.
What is the InChIKey of N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide?
The InChIKey is CRVBCQVIXQHIJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S2/c1-12-11-23-13(2)10-19(12)17(20)14-5-3-6-15(9-14)18-25(21,22)16-7-4-8-24-16/h3-9,12-13,18H,10-11H2,1-2H3.
What are the key properties of N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide?
N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide has a molecular weight of 380.49 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,5-dimethylmorpholine-4-carbonyl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 55831038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).