3,3-diethylpiperidin-2-one

C9H17NO — CID 10329495

IUPAC3,3-diethylpiperidin-2-one
SMILESCCC1(CC)CCCNC1=O
InChIInChI=1S/C9H17NO/c1-3-9(4-2)6-5-7-10-8(9)11/h3-7H2,1-2H3,(H,10,11)
InChIKeyFBHQJLKBGWTDRJ-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.70
Rot. Bonds2

About 3,3-diethylpiperidin-2-one

3,3-diethylpiperidin-2-one (PubChem CID 10329495) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 3,3-diethylpiperidin-2-one.

Molecular Properties

Compound Name3,3-diethylpiperidin-2-one
PubChem CID10329495
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name3,3-diethylpiperidin-2-one
SMILESCCC1(CC)CCCNC1=O
InChIInChI=1S/C9H17NO/c1-3-9(4-2)6-5-7-10-8(9)11/h3-7H2,1-2H3,(H,10,11)
InChIKeyFBHQJLKBGWTDRJ-UHFFFAOYSA-N
XLogP1.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Methyprylon
CID 4162
3,3-Diethyl-2,4-piperidinedione
CID 6465
3-Methylpiperidin-2-one
CID 107169
3-Ethylpiperidin-2-one
CID 10909585
4,4,6,6-Tetramethylazepan-2-one
CID 12689792
5,5-Dimethylpiperidin-2-one
CID 10479660
5-Methylpiperidin-2-one
CID 10877083
3,3-Dimethylpiperidin-2-one
CID 11240485
4-Methylpiperidin-2-one
CID 14146878
4-Ethylpiperidin-2-one
CID 179570
4,4-Dimethylpiperidin-2-one
CID 12202097
N-methyl-2-(piperidin-4-yl)acetamide
CID 20569899

Frequently Asked Questions

What is the IUPAC name of 3,3-diethylpiperidin-2-one?
The IUPAC name of 3,3-diethylpiperidin-2-one (CID 10329495) is 3,3-diethylpiperidin-2-one.
What is the SMILES notation for 3,3-diethylpiperidin-2-one?
The canonical SMILES for 3,3-diethylpiperidin-2-one is CCC1(CC)CCCNC1=O.
What is the InChIKey of 3,3-diethylpiperidin-2-one?
The InChIKey is FBHQJLKBGWTDRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-3-9(4-2)6-5-7-10-8(9)11/h3-7H2,1-2H3,(H,10,11).
What are the key properties of 3,3-diethylpiperidin-2-one?
3,3-diethylpiperidin-2-one has a molecular weight of 155.24 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diethylpiperidin-2-one is sourced from PubChem (CID 10329495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).