(4-ethylpiperidin-4-yl)-(furan-3-yl)methanone

C12H17NO2 — CID 116568189

IUPAC(4-ethylpiperidin-4-yl)-(furan-3-yl)methanone
SMILESCCC1(C(=O)c2ccoc2)CCNCC1
InChIInChI=1S/C12H17NO2/c1-2-12(4-6-13-7-5-12)11(14)10-3-8-15-9-10/h3,8-9,13H,2,4-7H2,1H3
InChIKeyLWIPOLBEVFNZBR-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.24
Rot. Bonds3

About (4-ethylpiperidin-4-yl)-(furan-3-yl)methanone

(4-ethylpiperidin-4-yl)-(furan-3-yl)methanone (PubChem CID 116568189) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is (4-ethylpiperidin-4-yl)-(furan-3-yl)methanone.

Molecular Properties

Compound Name(4-ethylpiperidin-4-yl)-(furan-3-yl)methanone
PubChem CID116568189
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name(4-ethylpiperidin-4-yl)-(furan-3-yl)methanone
SMILESCCC1(C(=O)c2ccoc2)CCNCC1
InChIInChI=1S/C12H17NO2/c1-2-12(4-6-13-7-5-12)11(14)10-3-8-15-9-10/h3,8-9,13H,2,4-7H2,1H3
InChIKeyLWIPOLBEVFNZBR-UHFFFAOYSA-N
XLogP2.24
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

furan-3-yl-(4-propylpiperidin-4-yl)methanone
CID 116569278
6-azaspiro[2.5]octan-2-yl(furan-3-yl)methanone
CID 116573257
(1-ethoxycyclopentyl)-(furan-3-yl)methanone
CID 116747796
furan-3-yl-(1-methylcyclohexyl)methanone
CID 106829578
(4-ethylpiperidin-4-yl)-(1-propylpyrazol-4-yl)methanone
CID 116567933
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]furan-3-carboxamide
CID 120887911
(4-ethylpiperidin-4-yl)-(2-fluorophenyl)methanone
CID 116568013
(3-bromothiophen-2-yl)-(4-ethylpiperidin-4-yl)methanone
CID 116568008
(5-ethoxy-3-pyridinyl)-(4-ethylpiperidin-4-yl)methanone
CID 116568171
4-ethyl-N-pyrrol-1-ylpiperidine-4-carboxamide
CID 79100981
(3-ethylpyrrolidin-3-yl)-(6-methyl-3-pyridinyl)methanone
CID 116570190
(4-propylphenyl)-(4-propylpiperidin-4-yl)methanone
CID 116569053

Frequently Asked Questions

What is the IUPAC name of (4-ethylpiperidin-4-yl)-(furan-3-yl)methanone?
The IUPAC name of (4-ethylpiperidin-4-yl)-(furan-3-yl)methanone (CID 116568189) is (4-ethylpiperidin-4-yl)-(furan-3-yl)methanone.
What is the SMILES notation for (4-ethylpiperidin-4-yl)-(furan-3-yl)methanone?
The canonical SMILES for (4-ethylpiperidin-4-yl)-(furan-3-yl)methanone is CCC1(C(=O)c2ccoc2)CCNCC1.
What is the InChIKey of (4-ethylpiperidin-4-yl)-(furan-3-yl)methanone?
The InChIKey is LWIPOLBEVFNZBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-2-12(4-6-13-7-5-12)11(14)10-3-8-15-9-10/h3,8-9,13H,2,4-7H2,1H3.
What are the key properties of (4-ethylpiperidin-4-yl)-(furan-3-yl)methanone?
(4-ethylpiperidin-4-yl)-(furan-3-yl)methanone has a molecular weight of 207.27 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylpiperidin-4-yl)-(furan-3-yl)methanone is sourced from PubChem (CID 116568189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).