2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide

C16H25N3O5S — CID 6493525

IUPAC2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide
SMILESCOc1ccc(S(=O)(=O)N(C)CC(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C16H25N3O5S/c1-18(25(21,22)15-5-3-14(23-2)4-6-15)13-16(20)17-7-8-19-9-11-24-12-10-19/h3-6H,7-13H2,1-2H3,(H,17,20)
InChIKeyLYFPLNKIBCTPJL-UHFFFAOYSA-N
MW371.46 g/mol
LogP-0.24
Rot. Bonds8

About 2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide

2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 6493525) has the molecular formula C16H25N3O5S and a molecular weight of 371.46 g/mol. Its IUPAC name is 2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID6493525
Molecular FormulaC16H25N3O5S
Molecular Weight371.46 g/mol
Exact Mass371.15
IUPAC Name2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide
SMILESCOc1ccc(S(=O)(=O)N(C)CC(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C16H25N3O5S/c1-18(25(21,22)15-5-3-14(23-2)4-6-15)13-16(20)17-7-8-19-9-11-24-12-10-19/h3-6H,7-13H2,1-2H3,(H,17,20)
InChIKeyLYFPLNKIBCTPJL-UHFFFAOYSA-N
XLogP-0.24
TPSA88.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.46
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide (CID 6493525) is 2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide is COc1ccc(S(=O)(=O)N(C)CC(=O)NCCN2CCOCC2)cc1.
What is the InChIKey of 2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is LYFPLNKIBCTPJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O5S/c1-18(25(21,22)15-5-3-14(23-2)4-6-15)13-16(20)17-7-8-19-9-11-24-12-10-19/h3-6H,7-13H2,1-2H3,(H,17,20).
What are the key properties of 2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide?
2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 371.46 g/mol, XLogP of -0.24, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 6493525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).