2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone

C9H13NO2 — CID 102652388

IUPAC2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone
SMILESO=C(C1=CCCO1)C1CCCN1
InChIInChI=1S/C9H13NO2/c11-9(7-3-1-5-10-7)8-4-2-6-12-8/h4,7,10H,1-3,5-6H2
InChIKeyVHBNUAFSRGHDHJ-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.61
Rot. Bonds2

About 2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone

2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone (PubChem CID 102652388) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone
PubChem CID102652388
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone
SMILESO=C(C1=CCCO1)C1CCCN1
InChIInChI=1S/C9H13NO2/c11-9(7-3-1-5-10-7)8-4-2-6-12-8/h4,7,10H,1-3,5-6H2
InChIKeyVHBNUAFSRGHDHJ-UHFFFAOYSA-N
XLogP0.61
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone?
The IUPAC name of 2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone (CID 102652388) is 2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone?
The canonical SMILES for 2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone is O=C(C1=CCCO1)C1CCCN1.
What is the InChIKey of 2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone?
The InChIKey is VHBNUAFSRGHDHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c11-9(7-3-1-5-10-7)8-4-2-6-12-8/h4,7,10H,1-3,5-6H2.
What are the key properties of 2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone?
2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone has a molecular weight of 167.21 g/mol, XLogP of 0.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl(pyrrolidin-2-yl)methanone is sourced from PubChem (CID 102652388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).