furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone

C10H11NO2 — CID 164652046

IUPACfuran-2-yl-(3-methylidenepyrrolidin-1-yl)methanone
SMILESC=C1CCN(C(=O)c2ccco2)C1
InChIInChI=1S/C10H11NO2/c1-8-4-5-11(7-8)10(12)9-3-2-6-13-9/h2-3,6H,1,4-5,7H2
InChIKeyRPZSJQRXAJTURK-UHFFFAOYSA-N
MW177.20 g/mol
LogP1.68
Rot. Bonds1

About furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone

furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone (PubChem CID 164652046) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone.

Molecular Properties

Compound Namefuran-2-yl-(3-methylidenepyrrolidin-1-yl)methanone
PubChem CID164652046
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Namefuran-2-yl-(3-methylidenepyrrolidin-1-yl)methanone
SMILESC=C1CCN(C(=O)c2ccco2)C1
InChIInChI=1S/C10H11NO2/c1-8-4-5-11(7-8)10(12)9-3-2-6-13-9/h2-3,6H,1,4-5,7H2
InChIKeyRPZSJQRXAJTURK-UHFFFAOYSA-N
XLogP1.68
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.68
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

(4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone
CID 121184150
azepan-1-yl(furan-2-yl)methanone
CID 5200992
furan-2-yl-(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 47284651
furan-2-yl(thiomorpholin-4-yl)methanone
CID 2804982
(2,3-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-(furan-2-yl)methanone
CID 71836369
1,4-dioxa-8-azaspiro[4.5]decan-8-yl(furan-2-yl)methanone
CID 2225250
3-azaspiro[5.5]undecan-3-yl(furan-2-yl)methanone
CID 62867411
2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide
CID 110294059
furan-2-yl(1,4,8-triazatricyclo[7.4.0.02,7]trideca-2(7),8,10,12-tetraen-4-yl)methanone
CID 110872518
(3,5-dimethylpiperidin-1-yl)-(furan-2-yl)methanone
CID 3554553
[(3R,5R)-3,5-dimethylpiperidin-1-yl]-(furan-2-yl)methanone
CID 669413
4-(furan-2-carbonyl)-1-propan-2-ylpiperazin-2-one
CID 110708964

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone?
The IUPAC name of furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone (CID 164652046) is furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone.
What is the SMILES notation for furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone?
The canonical SMILES for furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone is C=C1CCN(C(=O)c2ccco2)C1.
What is the InChIKey of furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone?
The InChIKey is RPZSJQRXAJTURK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-8-4-5-11(7-8)10(12)9-3-2-6-13-9/h2-3,6H,1,4-5,7H2.
What are the key properties of furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone?
furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone has a molecular weight of 177.20 g/mol, XLogP of 1.68, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-(3-methylidenepyrrolidin-1-yl)methanone is sourced from PubChem (CID 164652046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).