2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide

C17H26ClN3O4S — CID 55348116

IUPAC2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide
SMILESCC(NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NCC(C)(C)N1CCOCC1
InChIInChI=1S/C17H26ClN3O4S/c1-13(20-26(23,24)15-6-4-14(18)5-7-15)16(22)19-12-17(2,3)21-8-10-25-11-9-21/h4-7,13,20H,8-12H2,1-3H3,(H,19,22)
InChIKeyUWBUTZHGZKYCAI-UHFFFAOYSA-N
MW403.93 g/mol
LogP1.23
Rot. Bonds7

About 2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide

2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide (PubChem CID 55348116) has the molecular formula C17H26ClN3O4S and a molecular weight of 403.93 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide
PubChem CID55348116
Molecular FormulaC17H26ClN3O4S
Molecular Weight403.93 g/mol
Exact Mass403.13
IUPAC Name2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide
SMILESCC(NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NCC(C)(C)N1CCOCC1
InChIInChI=1S/C17H26ClN3O4S/c1-13(20-26(23,24)15-6-4-14(18)5-7-15)16(22)19-12-17(2,3)21-8-10-25-11-9-21/h4-7,13,20H,8-12H2,1-3H3,(H,19,22)
InChIKeyUWBUTZHGZKYCAI-UHFFFAOYSA-N
XLogP1.23
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.93
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-N-(1-morpholin-4-yl-1-oxopropan-2-yl)benzenesulfonamide
CID 2955346
2-[(4-chlorophenyl)sulfonylamino]-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
CID 55348790
N-(2-aminoethyl)-2-[(4-chlorophenyl)sulfonylamino]propanamide
CID 119383880
2-[(4-chlorophenyl)sulfonylamino]-N-[2-(ethylamino)ethyl]propanamide
CID 119507175
3-[2-[(4-chlorophenyl)sulfonylamino]propanoylamino]-2-methylpropanoic acid
CID 119237146
(2S)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 32767541
(2R)-2-amino-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide
CID 78973489
(2S)-2-[(4-chlorophenyl)sulfonylamino]-N-[2-(3,5-dimethylpiperidin-1-yl)ethyl]propanamide
CID 55939921
N-[1-[(2-methyl-2-morpholin-4-ylpropyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 51163384
(2S)-2-[(4-acetamidophenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide
CID 24619756
(2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(2,4,4-trimethylpentan-2-yl)propanamide
CID 55941880
(2S)-N-(2-bromoprop-2-enyl)-2-[(4-chlorophenyl)sulfonylamino]propanamide
CID 47439175

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide?
The IUPAC name of 2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide (CID 55348116) is 2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide.
What is the SMILES notation for 2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide?
The canonical SMILES for 2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide is CC(NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NCC(C)(C)N1CCOCC1.
What is the InChIKey of 2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide?
The InChIKey is UWBUTZHGZKYCAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26ClN3O4S/c1-13(20-26(23,24)15-6-4-14(18)5-7-15)16(22)19-12-17(2,3)21-8-10-25-11-9-21/h4-7,13,20H,8-12H2,1-3H3,(H,19,22).
What are the key properties of 2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide?
2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide has a molecular weight of 403.93 g/mol, XLogP of 1.23, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-2-morpholin-4-ylpropyl)propanamide is sourced from PubChem (CID 55348116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).