N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide

C19H22N2O3 — CID 112992328

IUPACN-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide
SMILESCC(NC(=O)CNC(=O)CCOc1ccccc1)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-15(16-8-4-2-5-9-16)21-19(23)14-20-18(22)12-13-24-17-10-6-3-7-11-17/h2-11,15H,12-14H2,1H3,(H,20,22)(H,21,23)
InChIKeyFMCBZTNXXLSIAI-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.45
Rot. Bonds8

About N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide

N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide (PubChem CID 112992328) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide.

Molecular Properties

Compound NameN-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide
PubChem CID112992328
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide
SMILESCC(NC(=O)CNC(=O)CCOc1ccccc1)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-15(16-8-4-2-5-9-16)21-19(23)14-20-18(22)12-13-24-17-10-6-3-7-11-17/h2-11,15H,12-14H2,1H3,(H,20,22)(H,21,23)
InChIKeyFMCBZTNXXLSIAI-UHFFFAOYSA-N
XLogP2.45
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 3-phenoxypropanoate
CID 9139913
N-[2-oxo-2-(1-phenylethylamino)ethyl]butanamide
CID 47205693
3-(3-methylphenoxy)-N-(1-phenylethyl)propanamide
CID 43006794
N-[(1R)-1-(4-fluorophenyl)ethyl]-4-phenoxybutanamide
CID 94330096
N-[(1R)-1-(4-ethylphenyl)ethyl]-4-phenoxybutanamide
CID 100521099
2-(4-butoxyanilino)-N-(1-phenylethyl)acetamide
CID 54820323
3-(4-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]propanamide
CID 43060182
3-methyl-N-[2-(3-phenoxypropanoylamino)ethyl]butanamide
CID 108538519
3-phenoxy-N-(1-thiophen-2-ylethyl)propanamide
CID 110733991
2-ethyl-N-[2-oxo-2-(1-phenylethylamino)ethyl]butanamide
CID 112992317
3-(4-ethylphenoxy)-N-[1-(4-ethylphenyl)ethyl]propanamide
CID 108795767
N-[2-oxo-2-(prop-2-enylamino)ethyl]-3-phenoxypropanamide
CID 112990545

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide?
The IUPAC name of N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide (CID 112992328) is N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide.
What is the SMILES notation for N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide?
The canonical SMILES for N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide is CC(NC(=O)CNC(=O)CCOc1ccccc1)c1ccccc1.
What is the InChIKey of N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide?
The InChIKey is FMCBZTNXXLSIAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-15(16-8-4-2-5-9-16)21-19(23)14-20-18(22)12-13-24-17-10-6-3-7-11-17/h2-11,15H,12-14H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide?
N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide has a molecular weight of 326.40 g/mol, XLogP of 2.45, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-(1-phenylethylamino)ethyl]-3-phenoxypropanamide is sourced from PubChem (CID 112992328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).