2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone

C12H13NO2 — CID 102652831

IUPAC2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone
SMILESCc1ccc(C(=O)C2=CCCO2)c(C)n1
InChIInChI=1S/C12H13NO2/c1-8-5-6-10(9(2)13-8)12(14)11-4-3-7-15-11/h4-6H,3,7H2,1-2H3
InChIKeyOSDDXFPDIXJPIL-UHFFFAOYSA-N
MW203.24 g/mol
LogP2.19
Rot. Bonds2

About 2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone

2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone (PubChem CID 102652831) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone
PubChem CID102652831
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC Name2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone
SMILESCc1ccc(C(=O)C2=CCCO2)c(C)n1
InChIInChI=1S/C12H13NO2/c1-8-5-6-10(9(2)13-8)12(14)11-4-3-7-15-11/h4-6H,3,7H2,1-2H3
InChIKeyOSDDXFPDIXJPIL-UHFFFAOYSA-N
XLogP2.19
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)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-(2,6-dimethyl-3-pyridinyl)methanone?
The IUPAC name of 2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone (CID 102652831) is 2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone?
The canonical SMILES for 2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone is Cc1ccc(C(=O)C2=CCCO2)c(C)n1.
What is the InChIKey of 2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone?
The InChIKey is OSDDXFPDIXJPIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2/c1-8-5-6-10(9(2)13-8)12(14)11-4-3-7-15-11/h4-6H,3,7H2,1-2H3.
What are the key properties of 2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone?
2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone has a molecular weight of 203.24 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl-(2,6-dimethyl-3-pyridinyl)methanone is sourced from PubChem (CID 102652831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).