(5-methyloxolan-3-yl)-piperidin-1-ylmethanone

C11H19NO2 — CID 114826120

IUPAC(5-methyloxolan-3-yl)-piperidin-1-ylmethanone
SMILESCC1CC(C(=O)N2CCCCC2)CO1
InChIInChI=1S/C11H19NO2/c1-9-7-10(8-14-9)11(13)12-5-3-2-4-6-12/h9-10H,2-8H2,1H3
InChIKeyJSHXAOOWAPLTCK-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.42
Rot. Bonds1

About (5-methyloxolan-3-yl)-piperidin-1-ylmethanone

(5-methyloxolan-3-yl)-piperidin-1-ylmethanone (PubChem CID 114826120) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is (5-methyloxolan-3-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(5-methyloxolan-3-yl)-piperidin-1-ylmethanone
PubChem CID114826120
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name(5-methyloxolan-3-yl)-piperidin-1-ylmethanone
SMILESCC1CC(C(=O)N2CCCCC2)CO1
InChIInChI=1S/C11H19NO2/c1-9-7-10(8-14-9)11(13)12-5-3-2-4-6-12/h9-10H,2-8H2,1H3
InChIKeyJSHXAOOWAPLTCK-UHFFFAOYSA-N
XLogP1.42
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-methyloxolan-3-yl)-piperidin-1-ylmethanone?
The IUPAC name of (5-methyloxolan-3-yl)-piperidin-1-ylmethanone (CID 114826120) is (5-methyloxolan-3-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (5-methyloxolan-3-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (5-methyloxolan-3-yl)-piperidin-1-ylmethanone is CC1CC(C(=O)N2CCCCC2)CO1.
What is the InChIKey of (5-methyloxolan-3-yl)-piperidin-1-ylmethanone?
The InChIKey is JSHXAOOWAPLTCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-9-7-10(8-14-9)11(13)12-5-3-2-4-6-12/h9-10H,2-8H2,1H3.
What are the key properties of (5-methyloxolan-3-yl)-piperidin-1-ylmethanone?
(5-methyloxolan-3-yl)-piperidin-1-ylmethanone has a molecular weight of 197.28 g/mol, XLogP of 1.42, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyloxolan-3-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 114826120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).