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

C11H17NO2 — CID 102652631

IUPAC2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone
SMILESCC1(C(=O)C2=CCCO2)CCCCN1
InChIInChI=1S/C11H17NO2/c1-11(6-2-3-7-12-11)10(13)9-5-4-8-14-9/h5,12H,2-4,6-8H2,1H3
InChIKeyXMANLWXTFGQBJR-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.39
Rot. Bonds2

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

2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone (PubChem CID 102652631) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone
PubChem CID102652631
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone
SMILESCC1(C(=O)C2=CCCO2)CCCCN1
InChIInChI=1S/C11H17NO2/c1-11(6-2-3-7-12-11)10(13)9-5-4-8-14-9/h5,12H,2-4,6-8H2,1H3
InChIKeyXMANLWXTFGQBJR-UHFFFAOYSA-N
XLogP1.39
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone?
The IUPAC name of 2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone (CID 102652631) is 2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone?
The canonical SMILES for 2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone is CC1(C(=O)C2=CCCO2)CCCCN1.
What is the InChIKey of 2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone?
The InChIKey is XMANLWXTFGQBJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-11(6-2-3-7-12-11)10(13)9-5-4-8-14-9/h5,12H,2-4,6-8H2,1H3.
What are the key properties of 2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone?
2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone has a molecular weight of 195.26 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone is sourced from PubChem (CID 102652631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).