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

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Related Compounds

(2-chlorofuran-3-yl)-(2,3-dihydrofuran-5-yl)methanone
CID 106691362
(2,6-dimethyl-3-pyridinyl)-(5-methylfuran-2-yl)methanone
CID 114995430
3,4-dihydro-2H-chromen-8-yl-(2,6-dimethyl-3-pyridinyl)methanone
CID 105133622
3,4-dihydro-2H-pyran-6-yl-(6-methylpyridazin-3-yl)methanone
CID 130956966
(2,6-dimethyl-3-pyridinyl)-(oxan-4-yl)methanone
CID 105099428
2,6-dimethylpyridine-3-carboxamide
CID 2824850
(4-chlorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone
CID 115604683
2,6-dimethylpyridine-3-carboxamide;hydrochloride
CID 67300853
(2,6-dimethyl-3-pyridinyl)-(1-methylpyrazol-4-yl)methanone
CID 105082299
1-(2,6-dimethyl-3-pyridinyl)prop-2-yn-1-one
CID 105108206
1-(2,6-dimethyl-3-pyridinyl)-2-methylpropan-1-one
CID 11030369
(2,4-difluorophenyl)-(2,6-dimethyl-3-pyridinyl)methanone
CID 113229974

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).