2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide

C22H27N3O2 — CID 55540684

IUPAC2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
SMILESO=C(CNC(Cc1ccccc1)c1ccccc1)NCC(=O)N1CCCC1
InChIInChI=1S/C22H27N3O2/c26-21(24-17-22(27)25-13-7-8-14-25)16-23-20(19-11-5-2-6-12-19)15-18-9-3-1-4-10-18/h1-6,9-12,20,23H,7-8,13-17H2,(H,24,26)
InChIKeyWKDNFDFDMQAJRY-UHFFFAOYSA-N
MW365.48 g/mol
LogP2.30
Rot. Bonds8

About 2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide

2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide (PubChem CID 55540684) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is 2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
PubChem CID55540684
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC Name2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
SMILESO=C(CNC(Cc1ccccc1)c1ccccc1)NCC(=O)N1CCCC1
InChIInChI=1S/C22H27N3O2/c26-21(24-17-22(27)25-13-7-8-14-25)16-23-20(19-11-5-2-6-12-19)15-18-9-3-1-4-10-18/h1-6,9-12,20,23H,7-8,13-17H2,(H,24,26)
InChIKeyWKDNFDFDMQAJRY-UHFFFAOYSA-N
XLogP2.30
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-phenylpropylamino)-1-piperidin-1-ylethanone
CID 54845364
1-(4-benzylsulfonylpiperazin-1-yl)-2-(1,2-diphenylethylamino)ethanone
CID 42887549
ethyl 4-[[2-(1,2-diphenylethylamino)acetyl]amino]piperidine-1-carboxylate
CID 78818038
N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-(1,2-diphenylethylamino)acetamide
CID 16561679
2-[[(1R)-1-phenylethyl]amino]-1-piperidin-1-ylethanone
CID 28564943
3-amino-N-(2-oxo-2-pyrrolidin-1-ylethyl)-2-phenylpropanamide
CID 115738074
N-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxoethyl]-2-phenylacetamide
CID 7472809
1-(2-oxo-2-pyrrolidin-1-ylethyl)-3-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]urea
CID 87003255
3-hydroxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)-3-phenylbutanamide
CID 110024517
2-(N-methylanilino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 47145142
N-(1,2-diphenylethyl)-1,4-thiazepane-4-carboxamide
CID 87000158
2-[[2-(azetidin-1-yl)-2-oxoethyl]amino]-2-phenylacetic acid
CID 55036831

Frequently Asked Questions

What is the IUPAC name of 2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
The IUPAC name of 2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide (CID 55540684) is 2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide.
What is the SMILES notation for 2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
The canonical SMILES for 2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide is O=C(CNC(Cc1ccccc1)c1ccccc1)NCC(=O)N1CCCC1.
What is the InChIKey of 2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
The InChIKey is WKDNFDFDMQAJRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c26-21(24-17-22(27)25-13-7-8-14-25)16-23-20(19-11-5-2-6-12-19)15-18-9-3-1-4-10-18/h1-6,9-12,20,23H,7-8,13-17H2,(H,24,26).
What are the key properties of 2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide has a molecular weight of 365.48 g/mol, XLogP of 2.30, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-diphenylethylamino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide is sourced from PubChem (CID 55540684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).