1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione

C16H22N2O2 — CID 79507326

IUPAC1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione
SMILESCCNC(CN1C(=O)CC(C)CC1=O)c1ccccc1
InChIInChI=1S/C16H22N2O2/c1-3-17-14(13-7-5-4-6-8-13)11-18-15(19)9-12(2)10-16(18)20/h4-8,12,14,17H,3,9-11H2,1-2H3
InChIKeyJSLLOTQHKMFZTQ-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.12
Rot. Bonds5

About 1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione

1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione (PubChem CID 79507326) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione.

Molecular Properties

Compound Name1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione
PubChem CID79507326
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione
SMILESCCNC(CN1C(=O)CC(C)CC1=O)c1ccccc1
InChIInChI=1S/C16H22N2O2/c1-3-17-14(13-7-5-4-6-8-13)11-18-15(19)9-12(2)10-16(18)20/h4-8,12,14,17H,3,9-11H2,1-2H3
InChIKeyJSLLOTQHKMFZTQ-UHFFFAOYSA-N
XLogP2.12
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(ethylamino)-2-phenylethyl]-4,4-dimethylpiperidine-2,6-dione
CID 62933262
1-[2-(ethylamino)-2-(4-propan-2-ylphenyl)ethyl]-4-methylpyrrolidin-2-one
CID 63103731
1-[2-(ethylamino)-2-phenylethyl]-3-methylpiperidin-2-one
CID 104680044
1-[2-(ethylamino)-2-(3-methoxyphenyl)ethyl]-4-methylpyrrolidin-2-one
CID 63103726
N-ethyl-1-phenyl-2-(4-propan-2-ylpiperidin-1-yl)ethanamine
CID 103495170
(1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen
CID 143114287
2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-N-ethyl-1-phenylethanamine
CID 82746306
N-ethyl-1-phenyl-3-(3,4,5-trimethylpiperazin-1-yl)propan-1-amine
CID 114539589
1-[2-(3,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyrrolidin-2-one
CID 63104056
1-[(1R)-2-hydroxy-1-phenylethyl]-4-methylpiperidine-2,6-dione
CID 95027251
3,3-dimethyl-1-[2-phenyl-2-(propylamino)ethyl]pyrrolidine-2,5-dione
CID 65301960
2-(4-tert-butylpiperidin-1-yl)-N-ethyl-1-phenylethanamine
CID 63468213

Frequently Asked Questions

What is the IUPAC name of 1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione?
The IUPAC name of 1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione (CID 79507326) is 1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione.
What is the SMILES notation for 1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione?
The canonical SMILES for 1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione is CCNC(CN1C(=O)CC(C)CC1=O)c1ccccc1.
What is the InChIKey of 1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione?
The InChIKey is JSLLOTQHKMFZTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-3-17-14(13-7-5-4-6-8-13)11-18-15(19)9-12(2)10-16(18)20/h4-8,12,14,17H,3,9-11H2,1-2H3.
What are the key properties of 1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione?
1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione has a molecular weight of 274.36 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(ethylamino)-2-phenylethyl]-4-methylpiperidine-2,6-dione is sourced from PubChem (CID 79507326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).