8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole

C64H73N5O8 — CID 161186301

IUPAC8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole
SMILESCC(C)c1cc2c3c(ccc2[nH]1)OCC3.CC(C)c1cc2c3c(ccc2[nH]1)OCCC3.CC(C)c1cc2c3c(ccc2[nH]1)OCCO3.CC(C)c1cc2c3c(ccc2[nH]1)OCO3.CC(C)c1cc2cc3c(cc2[nH]1)OCO3
InChIInChI=1S/C14H17NO.C13H15NO2.C13H15NO.2C12H13NO2/c1-9(2)13-8-11-10-4-3-7-16-14(10)6-5-12(11)15-13;1-8(2)11-7-9-10(14-11)3-4-12-13(9)16-6-5-15-12;1-8(2)12-7-10-9-5-6-15-13(9)4-3-11(10)14-12;1-7(2)9-3-8-4-11-12(15-6-14-11)5-10(8)13-9;1-7(2)10-5-8-9(13-10)3-4-11-12(8)15-6-14-11/h5-6,8-9,15H,3-4,7H2,1-2H3;3-4,7-8,14H,5-6H2,1-2H3;3-4,7-8,14H,5-6H2,1-2H3;2*3-5,7,13H,6H2,1-2H3
InChIKeyUTCWNGDETJYVBZ-UHFFFAOYSA-N
MW1040.31 g/mol
LogP15.94
Rot. Bonds5

About 8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole

8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole (PubChem CID 161186301) has the molecular formula C64H73N5O8 and a molecular weight of 1040.31 g/mol. Its IUPAC name is 8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole.

Molecular Properties

Compound Name8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole
PubChem CID161186301
Molecular FormulaC64H73N5O8
Molecular Weight1040.31 g/mol
Exact Mass1039.55
IUPAC Name8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole
SMILESCC(C)c1cc2c3c(ccc2[nH]1)OCC3.CC(C)c1cc2c3c(ccc2[nH]1)OCCC3.CC(C)c1cc2c3c(ccc2[nH]1)OCCO3.CC(C)c1cc2c3c(ccc2[nH]1)OCO3.CC(C)c1cc2cc3c(cc2[nH]1)OCO3
InChIInChI=1S/C14H17NO.C13H15NO2.C13H15NO.2C12H13NO2/c1-9(2)13-8-11-10-4-3-7-16-14(10)6-5-12(11)15-13;1-8(2)11-7-9-10(14-11)3-4-12-13(9)16-6-5-15-12;1-8(2)12-7-10-9-5-6-15-13(9)4-3-11(10)14-12;1-7(2)9-3-8-4-11-12(15-6-14-11)5-10(8)13-9;1-7(2)10-5-8-9(13-10)3-4-11-12(8)15-6-14-11/h5-6,8-9,15H,3-4,7H2,1-2H3;3-4,7-8,14H,5-6H2,1-2H3;3-4,7-8,14H,5-6H2,1-2H3;2*3-5,7,13H,6H2,1-2H3
InChIKeyUTCWNGDETJYVBZ-UHFFFAOYSA-N
XLogP15.94
TPSA152.79 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms77
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001040.31
LogP ≤ 515.94
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

Analyze 8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole with MolForge

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Related Compounds

16-[2-(9H-carbazol-4-yloxy)ethoxy]-17-methoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene bromide
CID 46231886
16-[3-(9H-carbazol-4-yloxy)propoxy]-17-methoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene bromide
CID 46231888
16-[4-(9H-carbazol-4-yloxy)butoxy]-17-methoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene bromide
CID 46231890
16-[5-(9H-carbazol-4-yloxy)pentoxy]-17-methoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene bromide
CID 46231892
16-[6-(9H-carbazol-4-yloxy)hexoxy]-17-methoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene bromide
CID 46231894
2-cyclopenta-1,4-dien-1-yl-1H-indole;1-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)indole;4-fluoro-2-phenyl-1H-indole;1-(4-fluorophenyl)-3-methyl-2-phenylindole;2-(2-fluorophenyl)-1-[4-(trifluoromethyl)phenyl]indole;2-[(E)-hex-1-enyl]-1H-indole;3-methyl-1-(2-methylphenyl)-2-phenylindole;2-pentyl-1H-indole;bis(2-phenyl-5-phenylmethoxy-1H-indole)
CID 157108999
2-cyclopenta-1,4-dien-1-yl-1H-indole;1-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)indole;4-fluoro-2-phenyl-1H-indole;2-(2-fluorophenyl)-1-[4-(trifluoromethyl)phenyl]indole;2-[(E)-hex-1-enyl]-1H-indole;2-pentyl-1H-indole;bis(2-phenyl-5-phenylmethoxy-1H-indole)
CID 157141755
1-(4-fluorophenyl)-3-methyl-2-phenylindole;1-(4-fluorophenyl)-2-phenylindole;3-(4-fluorophenyl)-2-phenyl-1H-indole;2-(3-methoxy-4-methylphenyl)-1-phenylindole;3-methyl-1-(2-methylphenyl)-2-phenylindole;3-methyl-2-(4-methylphenyl)-1-phenylindole;2-phenyl-5,6-bis(phenylmethoxy)-1H-indole;2-phenyl-3-(trifluoromethyl)-1H-indole
CID 160851977
8,10-difluoro-3-methyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole;3,8-dimethyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole;3,8-dimethyl-10-(trifluoromethyl)-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole;10-methoxy-3,8-dimethyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole;8-methoxy-3-methyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole;5-methyl-13,15-dioxa-5,9-diazatetracyclo[8.7.0.02,8.012,16]heptadeca-1(17),2(8),10,12(16)-tetraene;3-methyl-8-(trifluoromethoxy)-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole;3,8,9-trimethyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole
CID 167610338
6,12-Bis(1,3-benzodioxol-5-yl)-5,6,11,12-tetrahydroindolo[3,2-b]carbazole
CID 155805462
2,2-dimethyl-4,6,8-tri-o-tolyl-5H-[1,3]dioxolo[4,5-f]indole
CID 167713831
4,6,8-tris(2-methoxyphenyl)-2,2-dimethyl-5H-[1,3]dioxolo[4,5-f]indole
CID 167713832

Frequently Asked Questions

What is the IUPAC name of 8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole?
The IUPAC name of 8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole (CID 161186301) is 8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole.
What is the SMILES notation for 8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole?
The canonical SMILES for 8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole is CC(C)c1cc2c3c(ccc2[nH]1)OCC3.CC(C)c1cc2c3c(ccc2[nH]1)OCCC3.CC(C)c1cc2c3c(ccc2[nH]1)OCCO3.CC(C)c1cc2c3c(ccc2[nH]1)OCO3.CC(C)c1cc2cc3c(cc2[nH]1)OCO3.
What is the InChIKey of 8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole?
The InChIKey is UTCWNGDETJYVBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO.C13H15NO2.C13H15NO.2C12H13NO2/c1-9(2)13-8-11-10-4-3-7-16-14(10)6-5-12(11)15-13;1-8(2)11-7-9-10(14-11)3-4-12-13(9)16-6-5-15-12;1-8(2)12-7-10-9-5-6-15-13(9)4-3-11(10)14-12;1-7(2)9-3-8-4-11-12(15-6-14-11)5-10(8)13-9;1-7(2)10-5-8-9(13-10)3-4-11-12(8)15-6-14-11/h5-6,8-9,15H,3-4,7H2,1-2H3;3-4,7-8,14H,5-6H2,1-2H3;3-4,7-8,14H,5-6H2,1-2H3;2*3-5,7,13H,6H2,1-2H3.
What are the key properties of 8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole?
8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole has a molecular weight of 1040.31 g/mol, XLogP of 15.94, 5 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propan-2-yl-3,7-dihydro-2H-[1,4]dioxino[2,3-e]indole;7-propan-2-yl-2,6-dihydro-1H-furo[3,2-e]indole;7-propan-2-yl-6H-[1,3]dioxolo[4,5-e]indole;6-propan-2-yl-5H-[1,3]dioxolo[4,5-f]indole;2-propan-2-yl-3,7,8,9-tetrahydropyrano[3,2-e]indole is sourced from PubChem (CID 161186301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).