bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one

C198H230F4N26O29 — CID 159567726

IUPACbis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one
SMILESC=C1COc2cc(C)ccc2N1.C=C1COc2cc(C)cnc2N1.C=C1COc2cc(C)cnc2N1C.C=C1COc2nc(C)ccc2N1C.Cc1cc2c(cc1C)OCCO2.Cc1cc2c(cc1C)OCCO2.Cc1cc2c(cc1F)NCCO2.Cc1cc2c(cc1F)OCCO2.Cc1ccc2c(c1)OCC2.Cc1ccc2c(c1)OCCN2C.Cc1ccc2c(c1)OCCN2C.Cc1ccc2c(n1)OCC(=O)N2.Cc1ccc2c(n1)OCCC2.Cc1ccc2c(n1)OCCN2.Cc1ccc2c(n1)OCCO2.Cc1cnc2c(c1)C(=O)N(C)CC2.Cc1cnc2c(c1)OCC2.Cc1cnc2c(c1)OCCN2.Cc1cnc2c(c1)OCCN2C.Cc1cnc2c(c1)OCCO2.Cc1nc2c(cc1F)CCO2.Cc1nc2c(cc1F)OCCO2
InChIInChI=1S/3C10H12N2O.C10H11NO.2C10H13NO.2C10H12O2.C9H10FNO.C9H9FO2.C9H10N2O.C9H12N2O.C9H11NO.C9H10O.C8H8FNO2.C8H8FNO.C8H8N2O2.2C8H10N2O.2C8H9NO2.C8H9NO/c1-7-4-9-10(11-5-7)12(3)8(2)6-13-9;1-7-4-5-9-10(11-7)13-6-8(2)12(9)3;1-7-5-8-9(11-6-7)3-4-12(2)10(8)13;1-7-3-4-9-10(5-7)12-6-8(2)11-9;2*1-8-3-4-9-10(7-8)12-6-5-11(9)2;2*1-7-5-9-10(6-8(7)2)12-4-3-11-9;1-6-4-9-8(5-7(6)10)11-2-3-12-9;1-6-4-8-9(5-7(6)10)12-3-2-11-8;1-6-3-8-9(10-4-6)11-7(2)5-12-8;1-7-5-8-9(10-6-7)11(2)3-4-12-8;1-7-4-5-8-3-2-6-11-9(8)10-7;1-7-2-3-8-4-5-10-9(8)6-7;1-5-6(9)4-7-8(10-5)12-3-2-11-7;1-5-7(9)4-6-2-3-11-8(6)10-5;1-5-2-3-6-8(9-5)12-4-7(11)10-6;1-6-4-7-8(10-5-6)9-2-3-11-7;1-6-2-3-7-8(10-6)11-5-4-9-7;1-6-4-7-8(9-5-6)11-3-2-10-7;1-6-2-3-7-8(9-6)11-5-4-10-7;1-6-4-8-7(9-5-6)2-3-10-8/h2*4-5H,2,6H2,1,3H3;5-6H,3-4H2,1-2H3;3-5,11H,2,6H2,1H3;2*3-4,7H,5-6H2,1-2H3;2*5-6H,3-4H2,1-2H3;4-5,11H,2-3H2,1H3;4-5H,2-3H2,1H3;3-4H,2,5H2,1H3,(H,10,11);5-6H,3-4H2,1-2H3;4-5H,2-3,6H2,1H3;2-3,6H,4-5H2,1H3;4H,2-3H2,1H3;4H,2-3H2,1H3;2-3H,4H2,1H3,(H,10,11);4-5H,2-3H2,1H3,(H,9,10);2-3,9H,4-5H2,1H3;4-5H,2-3H2,1H3;2-3H,4-5H2,1H3;4-5H,2-3H2,1H3
InChIKeyMHKJZIBGCVKEQF-UHFFFAOYSA-N
MW3514.16 g/mol
LogP34.53
Rot. Bonds

About bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one

bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one (PubChem CID 159567726) has the molecular formula C198H230F4N26O29 and a molecular weight of 3514.16 g/mol. Its IUPAC name is bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one.

Molecular Properties

Compound Namebis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one
PubChem CID159567726
Molecular FormulaC198H230F4N26O29
Molecular Weight3514.16 g/mol
Exact Mass3511.73
IUPAC Namebis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one
SMILESC=C1COc2cc(C)ccc2N1.C=C1COc2cc(C)cnc2N1.C=C1COc2cc(C)cnc2N1C.C=C1COc2nc(C)ccc2N1C.Cc1cc2c(cc1C)OCCO2.Cc1cc2c(cc1C)OCCO2.Cc1cc2c(cc1F)NCCO2.Cc1cc2c(cc1F)OCCO2.Cc1ccc2c(c1)OCC2.Cc1ccc2c(c1)OCCN2C.Cc1ccc2c(c1)OCCN2C.Cc1ccc2c(n1)OCC(=O)N2.Cc1ccc2c(n1)OCCC2.Cc1ccc2c(n1)OCCN2.Cc1ccc2c(n1)OCCO2.Cc1cnc2c(c1)C(=O)N(C)CC2.Cc1cnc2c(c1)OCC2.Cc1cnc2c(c1)OCCN2.Cc1cnc2c(c1)OCCN2C.Cc1cnc2c(c1)OCCO2.Cc1nc2c(cc1F)CCO2.Cc1nc2c(cc1F)OCCO2
InChIInChI=1S/3C10H12N2O.C10H11NO.2C10H13NO.2C10H12O2.C9H10FNO.C9H9FO2.C9H10N2O.C9H12N2O.C9H11NO.C9H10O.C8H8FNO2.C8H8FNO.C8H8N2O2.2C8H10N2O.2C8H9NO2.C8H9NO/c1-7-4-9-10(11-5-7)12(3)8(2)6-13-9;1-7-4-5-9-10(11-7)13-6-8(2)12(9)3;1-7-5-8-9(11-6-7)3-4-12(2)10(8)13;1-7-3-4-9-10(5-7)12-6-8(2)11-9;2*1-8-3-4-9-10(7-8)12-6-5-11(9)2;2*1-7-5-9-10(6-8(7)2)12-4-3-11-9;1-6-4-9-8(5-7(6)10)11-2-3-12-9;1-6-4-8-9(5-7(6)10)12-3-2-11-8;1-6-3-8-9(10-4-6)11-7(2)5-12-8;1-7-5-8-9(10-6-7)11(2)3-4-12-8;1-7-4-5-8-3-2-6-11-9(8)10-7;1-7-2-3-8-4-5-10-9(8)6-7;1-5-6(9)4-7-8(10-5)12-3-2-11-7;1-5-7(9)4-6-2-3-11-8(6)10-5;1-5-2-3-6-8(9-5)12-4-7(11)10-6;1-6-4-7-8(10-5-6)9-2-3-11-7;1-6-2-3-7-8(10-6)11-5-4-9-7;1-6-4-7-8(9-5-6)11-3-2-10-7;1-6-2-3-7-8(9-6)11-5-4-10-7;1-6-4-8-7(9-5-6)2-3-10-8/h2*4-5H,2,6H2,1,3H3;5-6H,3-4H2,1-2H3;3-5,11H,2,6H2,1H3;2*3-4,7H,5-6H2,1-2H3;2*5-6H,3-4H2,1-2H3;4-5,11H,2-3H2,1H3;4-5H,2-3H2,1H3;3-4H,2,5H2,1H3,(H,10,11);5-6H,3-4H2,1-2H3;4-5H,2-3,6H2,1H3;2-3,6H,4-5H2,1H3;4H,2-3H2,1H3;4H,2-3H2,1H3;2-3H,4H2,1H3,(H,10,11);4-5H,2-3H2,1H3,(H,9,10);2-3,9H,4-5H2,1H3;4-5H,2-3H2,1H3;2-3H,4-5H2,1H3;4-5H,2-3H2,1H3
InChIKeyMHKJZIBGCVKEQF-UHFFFAOYSA-N
XLogP34.53
TPSA555.43 Ų
H-Bond Donors6
H-Bond Acceptors53
Rotatable Bonds
Heavy Atoms257
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003514.16
LogP ≤ 534.53
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1053

Analyze bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one?
The IUPAC name of bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one (CID 159567726) is bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one.
What is the SMILES notation for bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one?
The canonical SMILES for bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one is C=C1COc2cc(C)ccc2N1.C=C1COc2cc(C)cnc2N1.C=C1COc2cc(C)cnc2N1C.C=C1COc2nc(C)ccc2N1C.Cc1cc2c(cc1C)OCCO2.Cc1cc2c(cc1C)OCCO2.Cc1cc2c(cc1F)NCCO2.Cc1cc2c(cc1F)OCCO2.Cc1ccc2c(c1)OCC2.Cc1ccc2c(c1)OCCN2C.Cc1ccc2c(c1)OCCN2C.Cc1ccc2c(n1)OCC(=O)N2.Cc1ccc2c(n1)OCCC2.Cc1ccc2c(n1)OCCN2.Cc1ccc2c(n1)OCCO2.Cc1cnc2c(c1)C(=O)N(C)CC2.Cc1cnc2c(c1)OCC2.Cc1cnc2c(c1)OCCN2.Cc1cnc2c(c1)OCCN2C.Cc1cnc2c(c1)OCCO2.Cc1nc2c(cc1F)CCO2.Cc1nc2c(cc1F)OCCO2.
What is the InChIKey of bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one?
The InChIKey is MHKJZIBGCVKEQF-UHFFFAOYSA-N. The full InChI is InChI=1S/3C10H12N2O.C10H11NO.2C10H13NO.2C10H12O2.C9H10FNO.C9H9FO2.C9H10N2O.C9H12N2O.C9H11NO.C9H10O.C8H8FNO2.C8H8FNO.C8H8N2O2.2C8H10N2O.2C8H9NO2.C8H9NO/c1-7-4-9-10(11-5-7)12(3)8(2)6-13-9;1-7-4-5-9-10(11-7)13-6-8(2)12(9)3;1-7-5-8-9(11-6-7)3-4-12(2)10(8)13;1-7-3-4-9-10(5-7)12-6-8(2)11-9;2*1-8-3-4-9-10(7-8)12-6-5-11(9)2;2*1-7-5-9-10(6-8(7)2)12-4-3-11-9;1-6-4-9-8(5-7(6)10)11-2-3-12-9;1-6-4-8-9(5-7(6)10)12-3-2-11-8;1-6-3-8-9(10-4-6)11-7(2)5-12-8;1-7-5-8-9(10-6-7)11(2)3-4-12-8;1-7-4-5-8-3-2-6-11-9(8)10-7;1-7-2-3-8-4-5-10-9(8)6-7;1-5-6(9)4-7-8(10-5)12-3-2-11-7;1-5-7(9)4-6-2-3-11-8(6)10-5;1-5-2-3-6-8(9-5)12-4-7(11)10-6;1-6-4-7-8(10-5-6)9-2-3-11-7;1-6-2-3-7-8(10-6)11-5-4-9-7;1-6-4-7-8(9-5-6)11-3-2-10-7;1-6-2-3-7-8(9-6)11-5-4-10-7;1-6-4-8-7(9-5-6)2-3-10-8/h2*4-5H,2,6H2,1,3H3;5-6H,3-4H2,1-2H3;3-5,11H,2,6H2,1H3;2*3-4,7H,5-6H2,1-2H3;2*5-6H,3-4H2,1-2H3;4-5,11H,2-3H2,1H3;4-5H,2-3H2,1H3;3-4H,2,5H2,1H3,(H,10,11);5-6H,3-4H2,1-2H3;4-5H,2-3,6H2,1H3;2-3,6H,4-5H2,1H3;4H,2-3H2,1H3;4H,2-3H2,1H3;2-3H,4H2,1H3,(H,10,11);4-5H,2-3H2,1H3,(H,9,10);2-3,9H,4-5H2,1H3;4-5H,2-3H2,1H3;2-3H,4-5H2,1H3;4-5H,2-3H2,1H3.
What are the key properties of bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one?
bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one has a molecular weight of 3514.16 g/mol, XLogP of 34.53, 0 rotatable bonds, 6 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for bis(6,7-dimethyl-2,3-dihydro-1,4-benzodioxine);bis(4,7-dimethyl-2,3-dihydro-1,4-benzoxazine);3,6-dimethyl-7,8-dihydro-1,6-naphthyridin-5-one;4,7-dimethyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1,6-dimethyl-2-methylidenepyrido[2,3-b][1,4]oxazine;4,7-dimethyl-3-methylidenepyrido[3,2-b][1,4]oxazine;6-fluoro-7-methyl-2,3-dihydro-1,4-benzodioxine;6-fluoro-7-methyl-3,4-dihydro-2H-1,4-benzoxazine;7-fluoro-6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;5-fluoro-6-methyl-2,3-dihydrofuro[2,3-b]pyridine;6-methyl-2,3-dihydro-1-benzofuran;6-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-2,3-dihydrofuro[3,2-b]pyridine;7-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;6-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;7-methyl-3-methylidene-4H-1,4-benzoxazine;7-methyl-3-methylidene-4H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one is sourced from PubChem (CID 159567726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).