(2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide

C20H24N2O5S — CID 7612920

IUPAC(2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
SMILESCc1cccc(NC(=O)[C@H](C)Oc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1
InChIInChI=1S/C20H24N2O5S/c1-15-4-3-5-17(14-15)21-20(23)16(2)27-18-6-8-19(9-7-18)28(24,25)22-10-12-26-13-11-22/h3-9,14,16H,10-13H2,1-2H3,(H,21,23)/t16-/m0/s1
InChIKeyMGAPFSJXFCICAG-INIZCTEOSA-N
MW404.49 g/mol
LogP2.42
Rot. Bonds6

About (2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide

(2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide (PubChem CID 7612920) has the molecular formula C20H24N2O5S and a molecular weight of 404.49 g/mol. Its IUPAC name is (2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide.

Molecular Properties

Compound Name(2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
PubChem CID7612920
Molecular FormulaC20H24N2O5S
Molecular Weight404.49 g/mol
Exact Mass404.14
IUPAC Name(2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
SMILESCc1cccc(NC(=O)[C@H](C)Oc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1
InChIInChI=1S/C20H24N2O5S/c1-15-4-3-5-17(14-15)21-20(23)16(2)27-18-6-8-19(9-7-18)28(24,25)22-10-12-26-13-11-22/h3-9,14,16H,10-13H2,1-2H3,(H,21,23)/t16-/m0/s1
InChIKeyMGAPFSJXFCICAG-INIZCTEOSA-N
XLogP2.42
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.49
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide 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

2-(4-methylphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 2983188
2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 3153549
(2S)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-(3-methylphenoxy)propanamide
CID 7689037
(2S)-2-(3-methylphenoxy)-N-(4-piperidin-1-ylsulfonylphenyl)propanamide
CID 7760214
2-(3-methylphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)butanamide
CID 4928494
(2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
CID 41094222
(2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
CID 9332160
methyl (2S)-2-(4-morpholin-4-ylsulfonylphenoxy)propanoate
CID 9331081
(2S)-N-(3-methoxyphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)-2-phenylacetamide
CID 40814254
(2R)-N-(2-cyanophenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
CID 7612928
(2S)-N-(3-morpholin-4-ylsulfonylphenyl)-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]propanamide
CID 41213761
N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2-phenoxypropanamide
CID 43009352

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide?
The IUPAC name of (2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide (CID 7612920) is (2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide.
What is the SMILES notation for (2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide?
The canonical SMILES for (2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide is Cc1cccc(NC(=O)[C@H](C)Oc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1.
What is the InChIKey of (2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide?
The InChIKey is MGAPFSJXFCICAG-INIZCTEOSA-N. The full InChI is InChI=1S/C20H24N2O5S/c1-15-4-3-5-17(14-15)21-20(23)16(2)27-18-6-8-19(9-7-18)28(24,25)22-10-12-26-13-11-22/h3-9,14,16H,10-13H2,1-2H3,(H,21,23)/t16-/m0/s1.
What are the key properties of (2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide?
(2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide has a molecular weight of 404.49 g/mol, XLogP of 2.42, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide is sourced from PubChem (CID 7612920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).