5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine

C127H185N7O16 — CID 158925823

IUPAC5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.COc1cc2c(cc1C)CN(C)C2=O.Cc1c[nH]c(=O)c2ccoc12.Cc1cc(C)c2c(c1C)CCO2.Cc1cc(C)c2c(c1C)OCCO2.Cc1cc(C)c2c(c1C)OCO2.Cc1cc(C)c2c(n1)CCO2.Cc1cc(C)c2c(n1)OCCO2.Cc1cc(C)c2occc2c1.Cc1cc(C)c2occc2n1.Cc1cnc(C)c2c1OCC2.Cc1nc(C)c2c(c1C)CCO2
InChIInChI=1S/C11H13NO2.C11H14O2.C11H14O.C10H13NO.C10H12O2.C10H10O.C9H11NO2.2C9H11NO.C9H9NO.C8H7NO2.10C2H6/c1-7-4-8-6-12(2)11(13)9(8)5-10(7)14-3;1-7-6-8(2)10-11(9(7)3)13-5-4-12-10;1-7-6-8(2)11-10(9(7)3)4-5-12-11;1-6-7(2)11-8(3)10-9(6)4-5-12-10;1-6-4-7(2)9-10(8(6)3)12-5-11-9;1-7-5-8(2)10-9(6-7)3-4-11-10;1-6-5-7(2)10-9-8(6)11-3-4-12-9;1-6-5-10-7(2)8-3-4-11-9(6)8;2*1-6-5-7(2)10-8-3-4-11-9(6)8;1-5-4-9-8(10)6-2-3-11-7(5)6;10*1-2/h4-5H,6H2,1-3H3;6H,4-5H2,1-3H3;6H,4-5H2,1-3H3;4-5H2,1-3H3;4H,5H2,1-3H3;3-6H,1-2H3;5H,3-4H2,1-2H3;2*5H,3-4H2,1-2H3;3-5H,1-2H3;2-4H,1H3,(H,9,10);10*1-2H3
InChIKeyJIKSHCVUFYMKCA-UHFFFAOYSA-N
MW2065.91 g/mol
LogP32.72
Rot. Bonds1

About 5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine

5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine (PubChem CID 158925823) has the molecular formula C127H185N7O16 and a molecular weight of 2065.91 g/mol. Its IUPAC name is 5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine.

Molecular Properties

Compound Name5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine
PubChem CID158925823
Molecular FormulaC127H185N7O16
Molecular Weight2065.91 g/mol
Exact Mass2064.39
IUPAC Name5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.COc1cc2c(cc1C)CN(C)C2=O.Cc1c[nH]c(=O)c2ccoc12.Cc1cc(C)c2c(c1C)CCO2.Cc1cc(C)c2c(c1C)OCCO2.Cc1cc(C)c2c(c1C)OCO2.Cc1cc(C)c2c(n1)CCO2.Cc1cc(C)c2c(n1)OCCO2.Cc1cc(C)c2occc2c1.Cc1cc(C)c2occc2n1.Cc1cnc(C)c2c1OCC2.Cc1nc(C)c2c(c1C)CCO2
InChIInChI=1S/C11H13NO2.C11H14O2.C11H14O.C10H13NO.C10H12O2.C10H10O.C9H11NO2.2C9H11NO.C9H9NO.C8H7NO2.10C2H6/c1-7-4-8-6-12(2)11(13)9(8)5-10(7)14-3;1-7-6-8(2)10-11(9(7)3)13-5-4-12-10;1-7-6-8(2)11-10(9(7)3)4-5-12-11;1-6-7(2)11-8(3)10-9(6)4-5-12-10;1-6-4-7(2)9-10(8(6)3)12-5-11-9;1-7-5-8(2)10-9(6-7)3-4-11-10;1-6-5-7(2)10-9-8(6)11-3-4-12-9;1-6-5-10-7(2)8-3-4-11-9(6)8;2*1-6-5-7(2)10-8-3-4-11-9(6)8;1-5-4-9-8(10)6-2-3-11-7(5)6;10*1-2/h4-5H,6H2,1-3H3;6H,4-5H2,1-3H3;6H,4-5H2,1-3H3;4-5H2,1-3H3;4H,5H2,1-3H3;3-6H,1-2H3;5H,3-4H2,1-2H3;2*5H,3-4H2,1-2H3;3-5H,1-2H3;2-4H,1H3,(H,9,10);10*1-2H3
InChIKeyJIKSHCVUFYMKCA-UHFFFAOYSA-N
XLogP32.72
TPSA258.57 Ų
H-Bond Donors1
H-Bond Acceptors21
Rotatable Bonds1
Heavy Atoms150
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002065.91
LogP ≤ 532.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1021

Analyze 5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine?
The IUPAC name of 5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine (CID 158925823) is 5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine.
What is the SMILES notation for 5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine?
The canonical SMILES for 5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.COc1cc2c(cc1C)CN(C)C2=O.Cc1c[nH]c(=O)c2ccoc12.Cc1cc(C)c2c(c1C)CCO2.Cc1cc(C)c2c(c1C)OCCO2.Cc1cc(C)c2c(c1C)OCO2.Cc1cc(C)c2c(n1)CCO2.Cc1cc(C)c2c(n1)OCCO2.Cc1cc(C)c2occc2c1.Cc1cc(C)c2occc2n1.Cc1cnc(C)c2c1OCC2.Cc1nc(C)c2c(c1C)CCO2.
What is the InChIKey of 5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine?
The InChIKey is JIKSHCVUFYMKCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2.C11H14O2.C11H14O.C10H13NO.C10H12O2.C10H10O.C9H11NO2.2C9H11NO.C9H9NO.C8H7NO2.10C2H6/c1-7-4-8-6-12(2)11(13)9(8)5-10(7)14-3;1-7-6-8(2)10-11(9(7)3)13-5-4-12-10;1-7-6-8(2)11-10(9(7)3)4-5-12-11;1-6-7(2)11-8(3)10-9(6)4-5-12-10;1-6-4-7(2)9-10(8(6)3)12-5-11-9;1-7-5-8(2)10-9(6-7)3-4-11-10;1-6-5-7(2)10-9-8(6)11-3-4-12-9;1-6-5-10-7(2)8-3-4-11-9(6)8;2*1-6-5-7(2)10-8-3-4-11-9(6)8;1-5-4-9-8(10)6-2-3-11-7(5)6;10*1-2/h4-5H,6H2,1-3H3;6H,4-5H2,1-3H3;6H,4-5H2,1-3H3;4-5H2,1-3H3;4H,5H2,1-3H3;3-6H,1-2H3;5H,3-4H2,1-2H3;2*5H,3-4H2,1-2H3;3-5H,1-2H3;2-4H,1H3,(H,9,10);10*1-2H3.
What are the key properties of 5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine?
5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine has a molecular weight of 2065.91 g/mol, XLogP of 32.72, 1 rotatable bonds, 1 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-1-benzofuran;6,8-dimethyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5,7-dimethyl-2,3-dihydrofuro[3,2-b]pyridine;4,7-dimethyl-2,3-dihydrofuro[3,2-c]pyridine;5,7-dimethylfuro[3,2-b]pyridine;ethane;6-methoxy-2,5-dimethyl-3H-isoindol-1-one;7-methyl-5H-furo[3,2-c]pyridin-4-one;4,5,7-trimethyl-1,3-benzodioxole;5,6,8-trimethyl-2,3-dihydro-1,4-benzodioxine;4,5,7-trimethyl-2,3-dihydro-1-benzofuran;4,5,7-trimethyl-2,3-dihydrofuro[2,3-c]pyridine is sourced from PubChem (CID 158925823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).