4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide

C19H26N4O5S — CID 143943502

IUPAC4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide
SMILESCNC1CCN(C(=O)c2coc(CNS(=O)(=O)c3c(C)cc(OC)cc3C)n2)C1
InChIInChI=1S/C19H26N4O5S/c1-12-7-15(27-4)8-13(2)18(12)29(25,26)21-9-17-22-16(11-28-17)19(24)23-6-5-14(10-23)20-3/h7-8,11,14,20-21H,5-6,9-10H2,1-4H3
InChIKeyVTZWUZBXMJXCHS-UHFFFAOYSA-N
MW422.51 g/mol
LogP1.21
Rot. Bonds7

About 4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide

4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide (PubChem CID 143943502) has the molecular formula C19H26N4O5S and a molecular weight of 422.51 g/mol. Its IUPAC name is 4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide
PubChem CID143943502
Molecular FormulaC19H26N4O5S
Molecular Weight422.51 g/mol
Exact Mass422.16
IUPAC Name4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide
SMILESCNC1CCN(C(=O)c2coc(CNS(=O)(=O)c3c(C)cc(OC)cc3C)n2)C1
InChIInChI=1S/C19H26N4O5S/c1-12-7-15(27-4)8-13(2)18(12)29(25,26)21-9-17-22-16(11-28-17)19(24)23-6-5-14(10-23)20-3/h7-8,11,14,20-21H,5-6,9-10H2,1-4H3
InChIKeyVTZWUZBXMJXCHS-UHFFFAOYSA-N
XLogP1.21
TPSA113.77 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.51
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide 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 4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide?
The IUPAC name of 4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide (CID 143943502) is 4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide.
What is the SMILES notation for 4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide?
The canonical SMILES for 4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide is CNC1CCN(C(=O)c2coc(CNS(=O)(=O)c3c(C)cc(OC)cc3C)n2)C1.
What is the InChIKey of 4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide?
The InChIKey is VTZWUZBXMJXCHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O5S/c1-12-7-15(27-4)8-13(2)18(12)29(25,26)21-9-17-22-16(11-28-17)19(24)23-6-5-14(10-23)20-3/h7-8,11,14,20-21H,5-6,9-10H2,1-4H3.
What are the key properties of 4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide?
4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide has a molecular weight of 422.51 g/mol, XLogP of 1.21, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2,6-dimethyl-N-[[4-[3-(methylamino)pyrrolidine-1-carbonyl]-1,3-oxazol-2-yl]methyl]benzenesulfonamide is sourced from PubChem (CID 143943502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).