6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one

C15H26N2O2 — CID 115276298

IUPAC6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one
SMILESCN1CCC(CC(=O)N2CC(=O)CCC2(C)C)CC1
InChIInChI=1S/C15H26N2O2/c1-15(2)7-4-13(18)11-17(15)14(19)10-12-5-8-16(3)9-6-12/h12H,4-11H2,1-3H3
InChIKeyAMYUEZAMXMCQBP-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.69
Rot. Bonds2

About 6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one

6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one (PubChem CID 115276298) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one.

Molecular Properties

Compound Name6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one
PubChem CID115276298
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one
SMILESCN1CCC(CC(=O)N2CC(=O)CCC2(C)C)CC1
InChIInChI=1S/C15H26N2O2/c1-15(2)7-4-13(18)11-17(15)14(19)10-12-5-8-16(3)9-6-12/h12H,4-11H2,1-3H3
InChIKeyAMYUEZAMXMCQBP-UHFFFAOYSA-N
XLogP1.69
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-cyclopentylbutanoyl)-6,6-dimethylpiperidin-3-one
CID 115276326
1-butanoyl-6,6-dimethylpiperidin-3-one
CID 115269445
5,5-dimethyl-1-[4-(1-methylpyrrolidin-3-yl)butanoyl]pyrrolidin-3-one
CID 115275617
1-(3-hydroxy-2,2-dimethylpiperidin-1-yl)-2-(1-methylpiperidin-4-yl)ethanone
CID 115275797
1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one
CID 115276279
1-[2-(aminomethyl)-2-methylpyrrolidin-1-yl]-2-(1-methylpiperidin-4-yl)ethanone
CID 115270563
2-(1-methylpiperidin-4-yl)acetyl chloride
CID 13282022
1-[2-(4-fluorophenyl)acetyl]-6,6-dimethylpiperidin-3-one
CID 115269472
1-[2-(4-bromophenyl)acetyl]-6,6-dimethylpiperidin-3-one
CID 115269490
6,6-dimethyl-1-(oxane-4-carbonyl)piperidin-3-one
CID 115269494
1-(4-amino-3,3-dimethylpiperidin-1-yl)-2-(1-methylpiperidin-4-yl)ethanone
CID 115276675
1-[2-(2-fluorophenyl)acetyl]-6,6-dimethylpiperidin-3-one
CID 115269480

Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one?
The IUPAC name of 6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one (CID 115276298) is 6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one.
What is the SMILES notation for 6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one?
The canonical SMILES for 6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one is CN1CCC(CC(=O)N2CC(=O)CCC2(C)C)CC1.
What is the InChIKey of 6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one?
The InChIKey is AMYUEZAMXMCQBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-15(2)7-4-13(18)11-17(15)14(19)10-12-5-8-16(3)9-6-12/h12H,4-11H2,1-3H3.
What are the key properties of 6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one?
6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one has a molecular weight of 266.38 g/mol, XLogP of 1.69, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one is sourced from PubChem (CID 115276298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).