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

C11H15NO2 — CID 22905597

IUPACfuran-3-yl-(1-methylpiperidin-4-yl)methanone
SMILESCN1CCC(C(=O)c2ccoc2)CC1
InChIInChI=1S/C11H15NO2/c1-12-5-2-9(3-6-12)11(13)10-4-7-14-8-10/h4,7-9H,2-3,5-6H2,1H3
InChIKeyAXRVZBCSWOKHHK-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.80
Rot. Bonds2

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

furan-3-yl-(1-methylpiperidin-4-yl)methanone (PubChem CID 22905597) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is furan-3-yl-(1-methylpiperidin-4-yl)methanone.

Molecular Properties

Compound Namefuran-3-yl-(1-methylpiperidin-4-yl)methanone
PubChem CID22905597
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Namefuran-3-yl-(1-methylpiperidin-4-yl)methanone
SMILESCN1CCC(C(=O)c2ccoc2)CC1
InChIInChI=1S/C11H15NO2/c1-12-5-2-9(3-6-12)11(13)10-4-7-14-8-10/h4,7-9H,2-3,5-6H2,1H3
InChIKeyAXRVZBCSWOKHHK-UHFFFAOYSA-N
XLogP1.80
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of furan-3-yl-(1-methylpiperidin-4-yl)methanone?
The IUPAC name of furan-3-yl-(1-methylpiperidin-4-yl)methanone (CID 22905597) is furan-3-yl-(1-methylpiperidin-4-yl)methanone.
What is the SMILES notation for furan-3-yl-(1-methylpiperidin-4-yl)methanone?
The canonical SMILES for furan-3-yl-(1-methylpiperidin-4-yl)methanone is CN1CCC(C(=O)c2ccoc2)CC1.
What is the InChIKey of furan-3-yl-(1-methylpiperidin-4-yl)methanone?
The InChIKey is AXRVZBCSWOKHHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-12-5-2-9(3-6-12)11(13)10-4-7-14-8-10/h4,7-9H,2-3,5-6H2,1H3.
What are the key properties of furan-3-yl-(1-methylpiperidin-4-yl)methanone?
furan-3-yl-(1-methylpiperidin-4-yl)methanone has a molecular weight of 193.25 g/mol, XLogP of 1.80, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-(1-methylpiperidin-4-yl)methanone is sourced from PubChem (CID 22905597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).