N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide

C18H24N2O3S2 — CID 24815716

IUPACN-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide
SMILESCCN1CCOC(c2ccc(NS(=O)(=O)c3cc(C)sc3C)cc2)C1
InChIInChI=1S/C18H24N2O3S2/c1-4-20-9-10-23-17(12-20)15-5-7-16(8-6-15)19-25(21,22)18-11-13(2)24-14(18)3/h5-8,11,17,19H,4,9-10,12H2,1-3H3
InChIKeyCZEZOVDQQIDGMS-UHFFFAOYSA-N
MW380.54 g/mol
LogP3.56
Rot. Bonds5

About N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide

N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide (PubChem CID 24815716) has the molecular formula C18H24N2O3S2 and a molecular weight of 380.54 g/mol. Its IUPAC name is N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide.

Molecular Properties

Compound NameN-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide
PubChem CID24815716
Molecular FormulaC18H24N2O3S2
Molecular Weight380.54 g/mol
Exact Mass380.12
IUPAC NameN-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide
SMILESCCN1CCOC(c2ccc(NS(=O)(=O)c3cc(C)sc3C)cc2)C1
InChIInChI=1S/C18H24N2O3S2/c1-4-20-9-10-23-17(12-20)15-5-7-16(8-6-15)19-25(21,22)18-11-13(2)24-14(18)3/h5-8,11,17,19H,4,9-10,12H2,1-3H3
InChIKeyCZEZOVDQQIDGMS-UHFFFAOYSA-N
XLogP3.56
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.54
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide?
The IUPAC name of N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide (CID 24815716) is N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide.
What is the SMILES notation for N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide?
The canonical SMILES for N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide is CCN1CCOC(c2ccc(NS(=O)(=O)c3cc(C)sc3C)cc2)C1.
What is the InChIKey of N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide?
The InChIKey is CZEZOVDQQIDGMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3S2/c1-4-20-9-10-23-17(12-20)15-5-7-16(8-6-15)19-25(21,22)18-11-13(2)24-14(18)3/h5-8,11,17,19H,4,9-10,12H2,1-3H3.
What are the key properties of N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide?
N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide has a molecular weight of 380.54 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-ethylmorpholin-2-yl)phenyl]-2,5-dimethylthiophene-3-sulfonamide is sourced from PubChem (CID 24815716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).