1-piperidin-2-ylpentan-2-one

C10H19NO — CID 73083019

IUPAC1-piperidin-2-ylpentan-2-one
SMILESCCCC(=O)CC1CCCCN1
InChIInChI=1S/C10H19NO/c1-2-5-10(12)8-9-6-3-4-7-11-9/h9,11H,2-8H2,1H3
InChIKeyRKAFWGMBQWSOAC-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.89
Rot. Bonds4

About 1-piperidin-2-ylpentan-2-one

1-piperidin-2-ylpentan-2-one (PubChem CID 73083019) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-piperidin-2-ylpentan-2-one.

Molecular Properties

Compound Name1-piperidin-2-ylpentan-2-one
PubChem CID73083019
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-piperidin-2-ylpentan-2-one
SMILESCCCC(=O)CC1CCCCN1
InChIInChI=1S/C10H19NO/c1-2-5-10(12)8-9-6-3-4-7-11-9/h9,11H,2-8H2,1H3
InChIKeyRKAFWGMBQWSOAC-UHFFFAOYSA-N
XLogP1.89
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-piperidin-2-ylpentan-2-one?
The IUPAC name of 1-piperidin-2-ylpentan-2-one (CID 73083019) is 1-piperidin-2-ylpentan-2-one.
What is the SMILES notation for 1-piperidin-2-ylpentan-2-one?
The canonical SMILES for 1-piperidin-2-ylpentan-2-one is CCCC(=O)CC1CCCCN1.
What is the InChIKey of 1-piperidin-2-ylpentan-2-one?
The InChIKey is RKAFWGMBQWSOAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-5-10(12)8-9-6-3-4-7-11-9/h9,11H,2-8H2,1H3.
What are the key properties of 1-piperidin-2-ylpentan-2-one?
1-piperidin-2-ylpentan-2-one has a molecular weight of 169.27 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-2-ylpentan-2-one is sourced from PubChem (CID 73083019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).