N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide

C14H20N2O4S — CID 650123

IUPACN-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide
SMILESCC(=O)NCCc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C14H20N2O4S/c1-12(17)15-7-6-13-2-4-14(5-3-13)21(18,19)16-8-10-20-11-9-16/h2-5H,6-11H2,1H3,(H,15,17)
InChIKeyMCXVVSQVUOBOQP-UHFFFAOYSA-N
MW312.39 g/mol
LogP0.39
Rot. Bonds5

About N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide

N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide (PubChem CID 650123) has the molecular formula C14H20N2O4S and a molecular weight of 312.39 g/mol. Its IUPAC name is N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide
PubChem CID650123
Molecular FormulaC14H20N2O4S
Molecular Weight312.39 g/mol
Exact Mass312.11
IUPAC NameN-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide
SMILESCC(=O)NCCc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C14H20N2O4S/c1-12(17)15-7-6-13-2-4-14(5-3-13)21(18,19)16-8-10-20-11-9-16/h2-5H,6-11H2,1H3,(H,15,17)
InChIKeyMCXVVSQVUOBOQP-UHFFFAOYSA-N
XLogP0.39
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.39
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[4-(aminosulphonyl)phenyl]ethyl]acetamide
CID 745994
N-(3-{[(4-methylphenyl)sulfonyl]amino}propyl)acetamide
CID 2186028
1-Morpholino-2-(p-toluenesulfonyl)aminoethane
CID 567713
2-Amino-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide
CID 10848746
N-[2-(4-sulfamoylphenyl)ethyl]-3-sulfanylpropanamide
CID 23645368
2-piperidin-1-yl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 2697426
4-Methyl-N-(2-oxo-2-piperidin-1-yl-ethyl)-benzenesulfonamide
CID 751041
N-(2-methoxyethyl)-4-(5-oxopyrrolidin-3-yl)benzenesulfonamide
CID 4211783
2-Propyl-pentanoic acid [2-(4-sulfamoyl-phenyl)-ethyl]-amide
CID 11099458
2-ethyl-N-[2-(4-sulfamoylphenyl)ethyl]butanamide
CID 889524
4-(2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-ylsulfonyl)morpholine
CID 44573223
[4-(Morpholine-4-sulfonyl)phenyl]methanamine
CID 4962072

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide?
The IUPAC name of N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide (CID 650123) is N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide.
What is the SMILES notation for N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide?
The canonical SMILES for N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide is CC(=O)NCCc1ccc(S(=O)(=O)N2CCOCC2)cc1.
What is the InChIKey of N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide?
The InChIKey is MCXVVSQVUOBOQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4S/c1-12(17)15-7-6-13-2-4-14(5-3-13)21(18,19)16-8-10-20-11-9-16/h2-5H,6-11H2,1H3,(H,15,17).
What are the key properties of N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide?
N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide has a molecular weight of 312.39 g/mol, XLogP of 0.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]acetamide is sourced from PubChem (CID 650123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).