(2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate

C22H24N2O4 — CID 8921487

IUPAC(2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate
SMILESO=C(CNC(=O)c1ccc(-c2ccccc2)cc1)OCC(=O)N1CCCCC1
InChIInChI=1S/C22H24N2O4/c25-20(24-13-5-2-6-14-24)16-28-21(26)15-23-22(27)19-11-9-18(10-12-19)17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-16H2,(H,23,27)
InChIKeyGMWNQWIITBYFTL-UHFFFAOYSA-N
MW380.44 g/mol
LogP2.64
Rot. Bonds6

About (2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate

(2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate (PubChem CID 8921487) has the molecular formula C22H24N2O4 and a molecular weight of 380.44 g/mol. Its IUPAC name is (2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate.

Molecular Properties

Compound Name(2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate
PubChem CID8921487
Molecular FormulaC22H24N2O4
Molecular Weight380.44 g/mol
Exact Mass380.17
IUPAC Name(2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate
SMILESO=C(CNC(=O)c1ccc(-c2ccccc2)cc1)OCC(=O)N1CCCCC1
InChIInChI=1S/C22H24N2O4/c25-20(24-13-5-2-6-14-24)16-28-21(26)15-23-22(27)19-11-9-18(10-12-19)17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-16H2,(H,23,27)
InChIKeyGMWNQWIITBYFTL-UHFFFAOYSA-N
XLogP2.64
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.44
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate?
The IUPAC name of (2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate (CID 8921487) is (2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate.
What is the SMILES notation for (2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate?
The canonical SMILES for (2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate is O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)OCC(=O)N1CCCCC1.
What is the InChIKey of (2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate?
The InChIKey is GMWNQWIITBYFTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O4/c25-20(24-13-5-2-6-14-24)16-28-21(26)15-23-22(27)19-11-9-18(10-12-19)17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-16H2,(H,23,27).
What are the key properties of (2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate?
(2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate has a molecular weight of 380.44 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxo-2-piperidin-1-ylethyl) 2-[(4-phenylbenzoyl)amino]acetate is sourced from PubChem (CID 8921487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).