1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione

C17H30N2O2 — CID 104747634

IUPAC1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione
SMILESCCNC(CN1C(=O)CC(C)(C)CC1=O)C1CCCCC1
InChIInChI=1S/C17H30N2O2/c1-4-18-14(13-8-6-5-7-9-13)12-19-15(20)10-17(2,3)11-16(19)21/h13-14,18H,4-12H2,1-3H3
InChIKeyIESNUEKEFGSNNU-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.72
Rot. Bonds5

About 1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione

1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione (PubChem CID 104747634) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione.

Molecular Properties

Compound Name1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione
PubChem CID104747634
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione
SMILESCCNC(CN1C(=O)CC(C)(C)CC1=O)C1CCCCC1
InChIInChI=1S/C17H30N2O2/c1-4-18-14(13-8-6-5-7-9-13)12-19-15(20)10-17(2,3)11-16(19)21/h13-14,18H,4-12H2,1-3H3
InChIKeyIESNUEKEFGSNNU-UHFFFAOYSA-N
XLogP2.72
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.72
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-cyclohexyl-2-(propylamino)ethyl]pyrrolidine-2,5-dione
CID 104747098
4,4-dimethyl-1-[2-(oxolan-3-yl)-2-(propylamino)ethyl]piperidine-2,6-dione
CID 104747633
1-[2-cyclopentyl-2-(propylamino)ethyl]azepane-2,7-dione
CID 104747332
1-cyclohexyl-2-(4,4-dimethylazepan-1-yl)-N-ethylethanamine
CID 104746542
1-[2-cyclohexyl-2-(methylamino)ethyl]piperidine-2,6-dione
CID 113448405
1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine
CID 104746425
3-[2-cyclohexyl-2-(ethylamino)ethyl]-1,3-oxazolidin-2-one
CID 104747277
1-[2-(ethylamino)-2-phenylethyl]-4,4-dimethylpiperidine-2,6-dione
CID 62933262
1-cyclohexyl-N-ethylpropan-1-amine
CID 60817829
1-cyclohexyl-N-ethyl-2-(3,4,5-trimethylpyrazol-1-yl)ethanamine
CID 104747419
1-cyclohexyl-N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)ethanamine
CID 107391751
1-[2-cyclopentyl-2-(ethylamino)ethyl]-4-methylpyrazine-2,3-dione
CID 104747580

Frequently Asked Questions

What is the IUPAC name of 1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione?
The IUPAC name of 1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione (CID 104747634) is 1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione.
What is the SMILES notation for 1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione?
The canonical SMILES for 1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione is CCNC(CN1C(=O)CC(C)(C)CC1=O)C1CCCCC1.
What is the InChIKey of 1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione?
The InChIKey is IESNUEKEFGSNNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-4-18-14(13-8-6-5-7-9-13)12-19-15(20)10-17(2,3)11-16(19)21/h13-14,18H,4-12H2,1-3H3.
What are the key properties of 1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione?
1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione has a molecular weight of 294.44 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-cyclohexyl-2-(ethylamino)ethyl]-4,4-dimethylpiperidine-2,6-dione is sourced from PubChem (CID 104747634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).