(4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone

C13H15NO2 — CID 121184150

IUPAC(4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCC(=C2CC2)CC1
InChIInChI=1S/C13H15NO2/c15-13(12-2-1-9-16-12)14-7-5-11(6-8-14)10-3-4-10/h1-2,9H,3-8H2
InChIKeyUCQZZERKNVVLNK-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.61
Rot. Bonds1

About (4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone

(4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone (PubChem CID 121184150) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is (4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone.

Molecular Properties

Compound Name(4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone
PubChem CID121184150
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name(4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCC(=C2CC2)CC1
InChIInChI=1S/C13H15NO2/c15-13(12-2-1-9-16-12)14-7-5-11(6-8-14)10-3-4-10/h1-2,9H,3-8H2
InChIKeyUCQZZERKNVVLNK-UHFFFAOYSA-N
XLogP2.61
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

azepan-1-yl(furan-2-yl)methanone
CID 5200992
furan-2-yl(thiomorpholin-4-yl)methanone
CID 2804982
furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone
CID 164652046
1,4-dioxa-8-azaspiro[4.5]decan-8-yl(furan-2-yl)methanone
CID 2225250
[4-(2,6-dichlorobenzoyl)piperazin-1-yl]-(furan-2-yl)methanone
CID 7342085
3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone
CID 62867411
(3,5-dimethylpiperidin-1-yl)-(furan-2-yl)methanone
CID 3554553
[(3R,5R)-3,5-dimethylpiperidin-1-yl]-(furan-2-yl)methanone
CID 669413
1-[4-(furan-2-carbonyl)piperazin-1-yl]-2,2-dimethyl-3-pyrrolidin-1-ylpropane-1,3-dione
CID 108958407
[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone
CID 3433092
furan-2-yl-(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 47284651
N-[2-[4-(furan-2-carbonyl)piperazin-1-yl]ethyl]furan-2-carboxamide
CID 4051467

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone?
The IUPAC name of (4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone (CID 121184150) is (4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone.
What is the SMILES notation for (4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone?
The canonical SMILES for (4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone is O=C(c1ccco1)N1CCC(=C2CC2)CC1.
What is the InChIKey of (4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone?
The InChIKey is UCQZZERKNVVLNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c15-13(12-2-1-9-16-12)14-7-5-11(6-8-14)10-3-4-10/h1-2,9H,3-8H2.
What are the key properties of (4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone?
(4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone has a molecular weight of 217.27 g/mol, XLogP of 2.61, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone is sourced from PubChem (CID 121184150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).