2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone

C11H17NO2 — CID 118911401

IUPAC2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)C2=CCCO2)CC1
InChIInChI=1S/C11H17NO2/c1-9-4-6-12(7-5-9)11(13)10-3-2-8-14-10/h3,9H,2,4-8H2,1H3
InChIKeyLNDGOBWHCOHLPM-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.55
Rot. Bonds1

About 2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone

2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone (PubChem CID 118911401) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone
PubChem CID118911401
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)C2=CCCO2)CC1
InChIInChI=1S/C11H17NO2/c1-9-4-6-12(7-5-9)11(13)10-3-2-8-14-10/h3,9H,2,4-8H2,1H3
InChIKeyLNDGOBWHCOHLPM-UHFFFAOYSA-N
XLogP1.55
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of 2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone (CID 118911401) is 2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for 2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone is CC1CCN(C(=O)C2=CCCO2)CC1.
What is the InChIKey of 2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone?
The InChIKey is LNDGOBWHCOHLPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-9-4-6-12(7-5-9)11(13)10-3-2-8-14-10/h3,9H,2,4-8H2,1H3.
What are the key properties of 2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone?
2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone has a molecular weight of 195.26 g/mol, XLogP of 1.55, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 118911401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).