furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone

C14H14N2O2 — CID 24631497

IUPACfuran-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
SMILESO=C(c1ccoc1)N1CCCC1c1ccncc1
InChIInChI=1S/C14H14N2O2/c17-14(12-5-9-18-10-12)16-8-1-2-13(16)11-3-6-15-7-4-11/h3-7,9-10,13H,1-2,8H2
InChIKeyUQLZOWKQNMNHHP-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.65
Rot. Bonds2

About furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone

furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone (PubChem CID 24631497) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Namefuran-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
PubChem CID24631497
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Namefuran-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
SMILESO=C(c1ccoc1)N1CCCC1c1ccncc1
InChIInChI=1S/C14H14N2O2/c17-14(12-5-9-18-10-12)16-8-1-2-13(16)11-3-6-15-7-4-11/h3-7,9-10,13H,1-2,8H2
InChIKeyUQLZOWKQNMNHHP-UHFFFAOYSA-N
XLogP2.65
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone?
The IUPAC name of furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone (CID 24631497) is furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone.
What is the SMILES notation for furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone?
The canonical SMILES for furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone is O=C(c1ccoc1)N1CCCC1c1ccncc1.
What is the InChIKey of furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone?
The InChIKey is UQLZOWKQNMNHHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c17-14(12-5-9-18-10-12)16-8-1-2-13(16)11-3-6-15-7-4-11/h3-7,9-10,13H,1-2,8H2.
What are the key properties of furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone?
furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone has a molecular weight of 242.28 g/mol, XLogP of 2.65, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 24631497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).