N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide

C22H26N4O5S — CID 26542727

IUPACN-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
SMILESO=C(CNc1ccccc1N1CCCC1=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C22H26N4O5S/c27-21(16-23-19-7-1-2-8-20(19)26-10-4-9-22(26)28)24-17-5-3-6-18(15-17)32(29,30)25-11-13-31-14-12-25/h1-3,5-8,15,23H,4,9-14,16H2,(H,24,27)
InChIKeyKCEZQQBYSNGZJH-UHFFFAOYSA-N
MW458.54 g/mol
LogP1.88
Rot. Bonds7

About N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide

N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide (PubChem CID 26542727) has the molecular formula C22H26N4O5S and a molecular weight of 458.54 g/mol. Its IUPAC name is N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
PubChem CID26542727
Molecular FormulaC22H26N4O5S
Molecular Weight458.54 g/mol
Exact Mass458.16
IUPAC NameN-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
SMILESO=C(CNc1ccccc1N1CCCC1=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C22H26N4O5S/c27-21(16-23-19-7-1-2-8-20(19)26-10-4-9-22(26)28)24-17-5-3-6-18(15-17)32(29,30)25-11-13-31-14-12-25/h1-3,5-8,15,23H,4,9-14,16H2,(H,24,27)
InChIKeyKCEZQQBYSNGZJH-UHFFFAOYSA-N
XLogP1.88
TPSA108.05 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500458.54
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-chloro-5-morpholin-4-ylsulfonyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 43013801
N-(3-methylphenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide
CID 7409947
2-(2-chloroanilino)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 9098739
N-(2,6-dimethylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
CID 17491113
4-[[2-[2-(2-oxopyrrolidin-1-yl)anilino]acetyl]amino]benzamide
CID 17497451
N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
CID 41083870
2-[2-(2-oxopyrrolidin-1-yl)anilino]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 26542736
(2S)-N-(3-morpholin-4-ylsulfonylphenyl)-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]propanamide
CID 41213761
N-(2-ethyl-6-methylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide
CID 26542779
N-(2,5-difluorophenyl)-2-(3-morpholin-4-ylsulfonylanilino)acetamide
CID 9083286
2-(4-morpholin-4-ylsulfonylanilino)-N-phenylacetamide
CID 4880247
2-(4-aminophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide;hydrochloride
CID 119671802

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide?
The IUPAC name of N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide (CID 26542727) is N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide.
What is the SMILES notation for N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide?
The canonical SMILES for N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide is O=C(CNc1ccccc1N1CCCC1=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1.
What is the InChIKey of N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide?
The InChIKey is KCEZQQBYSNGZJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O5S/c27-21(16-23-19-7-1-2-8-20(19)26-10-4-9-22(26)28)24-17-5-3-6-18(15-17)32(29,30)25-11-13-31-14-12-25/h1-3,5-8,15,23H,4,9-14,16H2,(H,24,27).
What are the key properties of N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide?
N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide has a molecular weight of 458.54 g/mol, XLogP of 1.88, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)anilino]acetamide is sourced from PubChem (CID 26542727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).