N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide

C21H26N2O4S — CID 25161489

IUPACN-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide
SMILESCCCC(C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1
InChIInChI=1S/C21H26N2O4S/c1-2-6-20(17-7-4-3-5-8-17)21(24)22-18-9-11-19(12-10-18)28(25,26)23-13-15-27-16-14-23/h3-5,7-12,20H,2,6,13-16H2,1H3,(H,22,24)
InChIKeyGDTUZJCZRGXURX-UHFFFAOYSA-N
MW402.52 g/mol
LogP3.23
Rot. Bonds7

About N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide

N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide (PubChem CID 25161489) has the molecular formula C21H26N2O4S and a molecular weight of 402.52 g/mol. Its IUPAC name is N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide.

Molecular Properties

Compound NameN-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide
PubChem CID25161489
Molecular FormulaC21H26N2O4S
Molecular Weight402.52 g/mol
Exact Mass402.16
IUPAC NameN-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide
SMILESCCCC(C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1
InChIInChI=1S/C21H26N2O4S/c1-2-6-20(17-7-4-3-5-8-17)21(24)22-18-9-11-19(12-10-18)28(25,26)23-13-15-27-16-14-23/h3-5,7-12,20H,2,6,13-16H2,1H3,(H,22,24)
InChIKeyGDTUZJCZRGXURX-UHFFFAOYSA-N
XLogP3.23
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.52
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide 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-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide?
The IUPAC name of N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide (CID 25161489) is N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide.
What is the SMILES notation for N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide?
The canonical SMILES for N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide is CCCC(C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1.
What is the InChIKey of N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide?
The InChIKey is GDTUZJCZRGXURX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O4S/c1-2-6-20(17-7-4-3-5-8-17)21(24)22-18-9-11-19(12-10-18)28(25,26)23-13-15-27-16-14-23/h3-5,7-12,20H,2,6,13-16H2,1H3,(H,22,24).
What are the key properties of N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide?
N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide has a molecular weight of 402.52 g/mol, XLogP of 3.23, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-morpholin-4-ylsulfonylphenyl)-2-phenylpentanamide is sourced from PubChem (CID 25161489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).