N-(4-morpholin-4-ylsulfonylphenyl)propanamide

C13H18N2O4S — CID 832676

IUPACN-(4-morpholin-4-ylsulfonylphenyl)propanamide
SMILESCCC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C13H18N2O4S/c1-2-13(16)14-11-3-5-12(6-4-11)20(17,18)15-7-9-19-10-8-15/h3-6H,2,7-10H2,1H3,(H,14,16)
InChIKeyVEZLOIGXRVNIPX-UHFFFAOYSA-N
MW298.36 g/mol
LogP1.06
Rot. Bonds4

About N-(4-morpholin-4-ylsulfonylphenyl)propanamide

N-(4-morpholin-4-ylsulfonylphenyl)propanamide (PubChem CID 832676) has the molecular formula C13H18N2O4S and a molecular weight of 298.36 g/mol. Its IUPAC name is N-(4-morpholin-4-ylsulfonylphenyl)propanamide.

Molecular Properties

Compound NameN-(4-morpholin-4-ylsulfonylphenyl)propanamide
PubChem CID832676
Molecular FormulaC13H18N2O4S
Molecular Weight298.36 g/mol
Exact Mass298.10
IUPAC NameN-(4-morpholin-4-ylsulfonylphenyl)propanamide
SMILESCCC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C13H18N2O4S/c1-2-13(16)14-11-3-5-12(6-4-11)20(17,18)15-7-9-19-10-8-15/h3-6H,2,7-10H2,1H3,(H,14,16)
InChIKeyVEZLOIGXRVNIPX-UHFFFAOYSA-N
XLogP1.06
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.36
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-morpholin-4-ylsulfonylphenyl)butanamide
CID 832695
N,N'-bis(4-morpholin-4-ylsulfonylphenyl)decanediamide
CID 17080112
2-(butan-2-ylamino)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 4671972
(2R)-2-methyl-N-(4-morpholin-4-ylsulfonylphenyl)butanamide
CID 697456
2-(4-ethylpyridin-1-ium-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 8857820
2-(4-tert-butylanilino)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 25483949
N-(4-morpholin-4-ylsulfonylphenyl)-4-(pentanoylamino)benzamide
CID 2211272
2-(4-morpholin-4-ylsulfonylanilino)-N-phenylacetamide
CID 4880247
2-(4-methylpiperidin-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 1152713
3-(4-methylphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 19061853
N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide
CID 1164401
[2-(4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 3-methylbut-2-enoate
CID 8760066

Frequently Asked Questions

What is the IUPAC name of N-(4-morpholin-4-ylsulfonylphenyl)propanamide?
The IUPAC name of N-(4-morpholin-4-ylsulfonylphenyl)propanamide (CID 832676) is N-(4-morpholin-4-ylsulfonylphenyl)propanamide.
What is the SMILES notation for N-(4-morpholin-4-ylsulfonylphenyl)propanamide?
The canonical SMILES for N-(4-morpholin-4-ylsulfonylphenyl)propanamide is CCC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1.
What is the InChIKey of N-(4-morpholin-4-ylsulfonylphenyl)propanamide?
The InChIKey is VEZLOIGXRVNIPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4S/c1-2-13(16)14-11-3-5-12(6-4-11)20(17,18)15-7-9-19-10-8-15/h3-6H,2,7-10H2,1H3,(H,14,16).
What are the key properties of N-(4-morpholin-4-ylsulfonylphenyl)propanamide?
N-(4-morpholin-4-ylsulfonylphenyl)propanamide has a molecular weight of 298.36 g/mol, XLogP of 1.06, 4 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)propanamide is sourced from PubChem (CID 832676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).