1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione

C14H24N2O2 — CID 114280946

IUPAC1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione
SMILESCCC1(CN2C(=O)CC(C)CC2=O)CCCNC1
InChIInChI=1S/C14H24N2O2/c1-3-14(5-4-6-15-9-14)10-16-12(17)7-11(2)8-13(16)18/h11,15H,3-10H2,1-2H3
InChIKeyUJMHYDHNJRDGLP-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.55
Rot. Bonds3

About 1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione

1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione (PubChem CID 114280946) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione.

Molecular Properties

Compound Name1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione
PubChem CID114280946
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione
SMILESCCC1(CN2C(=O)CC(C)CC2=O)CCCNC1
InChIInChI=1S/C14H24N2O2/c1-3-14(5-4-6-15-9-14)10-16-12(17)7-11(2)8-13(16)18/h11,15H,3-10H2,1-2H3
InChIKeyUJMHYDHNJRDGLP-UHFFFAOYSA-N
XLogP1.55
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.55
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-[[3-(methoxymethyl)piperidin-3-yl]methyl]-3-methylpyrrolidine-2,5-dione
CID 114280953
1-[(3-ethylpiperidin-3-yl)methyl]azocane
CID 55166633
3-ethyl-3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]piperidine
CID 83219848
4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine
CID 63161620
N-[(3-ethylpiperidin-3-yl)methyl]propan-2-amine
CID 63133337
2-[(3-ethylpiperidin-3-yl)methyl]-3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 79944035
1-[[1-(hydroxymethyl)cyclopentyl]methyl]-3-methylpyrrolidine-2,5-dione
CID 115363188
2-ethyl-4-[(3-ethylpiperidin-3-yl)methyl]morpholine
CID 63132829
ethane;2-(3-ethylpiperidin-3-yl)ethanamine
CID 143578860
3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine
CID 55167023
N-[(3-ethylpiperidin-3-yl)methyl]-N,3-dimethylcyclohexan-1-amine
CID 63132931
1-[(4-hydroxyoxan-4-yl)methyl]-4-methylpiperidine-2,6-dione
CID 81131359

Frequently Asked Questions

What is the IUPAC name of 1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione?
The IUPAC name of 1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione (CID 114280946) is 1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione.
What is the SMILES notation for 1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione?
The canonical SMILES for 1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione is CCC1(CN2C(=O)CC(C)CC2=O)CCCNC1.
What is the InChIKey of 1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione?
The InChIKey is UJMHYDHNJRDGLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-3-14(5-4-6-15-9-14)10-16-12(17)7-11(2)8-13(16)18/h11,15H,3-10H2,1-2H3.
What are the key properties of 1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione?
1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione has a molecular weight of 252.36 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine-2,6-dione is sourced from PubChem (CID 114280946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).