2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide

C19H28N2O3 — CID 145134644

IUPAC2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide
SMILESCCCC(CC)C(=O)N(CC=O)CC(=O)NCCc1ccccc1
InChIInChI=1S/C19H28N2O3/c1-3-8-17(4-2)19(24)21(13-14-22)15-18(23)20-12-11-16-9-6-5-7-10-16/h5-7,9-10,14,17H,3-4,8,11-13,15H2,1-2H3,(H,20,23)
InChIKeyCHVXHKNBPVONGA-UHFFFAOYSA-N
MW332.44 g/mol
LogP2.20
Rot. Bonds11

About 2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide

2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide (PubChem CID 145134644) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is 2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide.

Molecular Properties

Compound Name2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide
PubChem CID145134644
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC Name2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide
SMILESCCCC(CC)C(=O)N(CC=O)CC(=O)NCCc1ccccc1
InChIInChI=1S/C19H28N2O3/c1-3-8-17(4-2)19(24)21(13-14-22)15-18(23)20-12-11-16-9-6-5-7-10-16/h5-7,9-10,14,17H,3-4,8,11-13,15H2,1-2H3,(H,20,23)
InChIKeyCHVXHKNBPVONGA-UHFFFAOYSA-N
XLogP2.20
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide?
The IUPAC name of 2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide (CID 145134644) is 2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide.
What is the SMILES notation for 2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide?
The canonical SMILES for 2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide is CCCC(CC)C(=O)N(CC=O)CC(=O)NCCc1ccccc1.
What is the InChIKey of 2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide?
The InChIKey is CHVXHKNBPVONGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-3-8-17(4-2)19(24)21(13-14-22)15-18(23)20-12-11-16-9-6-5-7-10-16/h5-7,9-10,14,17H,3-4,8,11-13,15H2,1-2H3,(H,20,23).
What are the key properties of 2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide?
2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide has a molecular weight of 332.44 g/mol, XLogP of 2.20, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(2-oxoethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]pentanamide is sourced from PubChem (CID 145134644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).