(4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone

C11H19NO2 — CID 58395368

IUPAC(4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone
SMILESCC1CCN(C(=O)C2CCOC2)CC1
InChIInChI=1S/C11H19NO2/c1-9-2-5-12(6-3-9)11(13)10-4-7-14-8-10/h9-10H,2-8H2,1H3
InChIKeyASFKIQJHDVNSIO-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.28
Rot. Bonds1

About (4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone

(4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone (PubChem CID 58395368) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is (4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone.

Molecular Properties

Compound Name(4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone
PubChem CID58395368
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name(4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone
SMILESCC1CCN(C(=O)C2CCOC2)CC1
InChIInChI=1S/C11H19NO2/c1-9-2-5-12(6-3-9)11(13)10-4-7-14-8-10/h9-10H,2-8H2,1H3
InChIKeyASFKIQJHDVNSIO-UHFFFAOYSA-N
XLogP1.28
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 ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone?
The IUPAC name of (4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone (CID 58395368) is (4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone.
What is the SMILES notation for (4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone?
The canonical SMILES for (4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone is CC1CCN(C(=O)C2CCOC2)CC1.
What is the InChIKey of (4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone?
The InChIKey is ASFKIQJHDVNSIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-9-2-5-12(6-3-9)11(13)10-4-7-14-8-10/h9-10H,2-8H2,1H3.
What are the key properties of (4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone?
(4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone has a molecular weight of 197.28 g/mol, XLogP of 1.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpiperidin-1-yl)-(oxolan-3-yl)methanone is sourced from PubChem (CID 58395368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).