1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene

C192H320N14O5 — CID 158144559

IUPAC1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc2c(c1)CCC2.Cc1ccc2c(c1)CCCC2.Cc1ccc2c(c1)CN(C)C2=O.Cc1ccc2c(ccn2C)c1.Cc1ccc2c(cnn2C)c1.Cc1ccc2ccccc2c1.Cc1ccc2cccnc2c1.Cc1ccc2ccn(C)c2c1.Cc1ccc2cnn(C)c2c1.Cc1ccc2cnoc2c1.Cc1ccc2nc[nH]c2c1.Cc1ccc2ncoc2c1.Cc1ccc2ocnc2c1.Cc1ccc2oncc2c1
InChIInChI=1S/C11H14.C11H10.C10H11NO.2C10H11N.C10H9N.C10H12.2C9H10N2.C8H8N2.4C8H7NO.31C2H6/c2*1-9-6-7-10-4-2-3-5-11(10)8-9;1-7-3-4-9-8(5-7)6-11(2)10(9)12;1-8-3-4-10-9(7-8)5-6-11(10)2;1-8-3-4-9-5-6-11(2)10(9)7-8;1-8-4-5-9-3-2-6-11-10(9)7-8;1-8-5-6-9-3-2-4-10(9)7-8;1-7-3-4-9-8(5-7)6-10-11(9)2;1-7-3-4-8-6-10-11(2)9(8)5-7;1-6-2-3-7-8(4-6)10-5-9-7;1-6-2-3-8-7(4-6)9-5-10-8;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-8(4-6)10-5-9-7;1-6-2-3-7-5-9-10-8(7)4-6;31*1-2/h6-8H,2-5H2,1H3;2-8H,1H3;3-5H,6H2,1-2H3;2*3-7H,1-2H3;2-7H,1H3;5-7H,2-4H2,1H3;2*3-6H,1-2H3;2-5H,1H3,(H,9,10);4*2-5H,1H3;31*1-2H3
InChIKeyFUIXTVPLJVYMPH-UHFFFAOYSA-N
MW2904.76 g/mol
LogP63.59
Rot. Bonds

About 1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene

1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene (PubChem CID 158144559) has the molecular formula C192H320N14O5 and a molecular weight of 2904.76 g/mol. Its IUPAC name is 1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene
PubChem CID158144559
Molecular FormulaC192H320N14O5
Molecular Weight2904.76 g/mol
Exact Mass2902.52
IUPAC Name1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc2c(c1)CCC2.Cc1ccc2c(c1)CCCC2.Cc1ccc2c(c1)CN(C)C2=O.Cc1ccc2c(ccn2C)c1.Cc1ccc2c(cnn2C)c1.Cc1ccc2ccccc2c1.Cc1ccc2cccnc2c1.Cc1ccc2ccn(C)c2c1.Cc1ccc2cnn(C)c2c1.Cc1ccc2cnoc2c1.Cc1ccc2nc[nH]c2c1.Cc1ccc2ncoc2c1.Cc1ccc2ocnc2c1.Cc1ccc2oncc2c1
InChIInChI=1S/C11H14.C11H10.C10H11NO.2C10H11N.C10H9N.C10H12.2C9H10N2.C8H8N2.4C8H7NO.31C2H6/c2*1-9-6-7-10-4-2-3-5-11(10)8-9;1-7-3-4-9-8(5-7)6-11(2)10(9)12;1-8-3-4-10-9(7-8)5-6-11(10)2;1-8-3-4-9-5-6-11(2)10(9)7-8;1-8-4-5-9-3-2-6-11-10(9)7-8;1-8-5-6-9-3-2-4-10(9)7-8;1-7-3-4-9-8(5-7)6-10-11(9)2;1-7-3-4-8-6-10-11(2)9(8)5-7;1-6-2-3-7-8(4-6)10-5-9-7;1-6-2-3-8-7(4-6)9-5-10-8;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-8(4-6)10-5-9-7;1-6-2-3-7-5-9-10-8(7)4-6;31*1-2/h6-8H,2-5H2,1H3;2-8H,1H3;3-5H,6H2,1-2H3;2*3-7H,1-2H3;2-7H,1H3;5-7H,2-4H2,1H3;2*3-6H,1-2H3;2-5H,1H3,(H,9,10);4*2-5H,1H3;31*1-2H3
InChIKeyFUIXTVPLJVYMPH-UHFFFAOYSA-N
XLogP63.59
TPSA211.50 Ų
H-Bond Donors1
H-Bond Acceptors17
Rotatable Bonds
Heavy Atoms211
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002904.76
LogP ≤ 563.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1017

Analyze 1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene 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 1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene (CID 158144559) is 1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc2c(c1)CCC2.Cc1ccc2c(c1)CCCC2.Cc1ccc2c(c1)CN(C)C2=O.Cc1ccc2c(ccn2C)c1.Cc1ccc2c(cnn2C)c1.Cc1ccc2ccccc2c1.Cc1ccc2cccnc2c1.Cc1ccc2ccn(C)c2c1.Cc1ccc2cnn(C)c2c1.Cc1ccc2cnoc2c1.Cc1ccc2nc[nH]c2c1.Cc1ccc2ncoc2c1.Cc1ccc2ocnc2c1.Cc1ccc2oncc2c1.
What is the InChIKey of 1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene?
The InChIKey is FUIXTVPLJVYMPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14.C11H10.C10H11NO.2C10H11N.C10H9N.C10H12.2C9H10N2.C8H8N2.4C8H7NO.31C2H6/c2*1-9-6-7-10-4-2-3-5-11(10)8-9;1-7-3-4-9-8(5-7)6-11(2)10(9)12;1-8-3-4-10-9(7-8)5-6-11(10)2;1-8-3-4-9-5-6-11(2)10(9)7-8;1-8-4-5-9-3-2-6-11-10(9)7-8;1-8-5-6-9-3-2-4-10(9)7-8;1-7-3-4-9-8(5-7)6-10-11(9)2;1-7-3-4-8-6-10-11(2)9(8)5-7;1-6-2-3-7-8(4-6)10-5-9-7;1-6-2-3-8-7(4-6)9-5-10-8;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-8(4-6)10-5-9-7;1-6-2-3-7-5-9-10-8(7)4-6;31*1-2/h6-8H,2-5H2,1H3;2-8H,1H3;3-5H,6H2,1-2H3;2*3-7H,1-2H3;2-7H,1H3;5-7H,2-4H2,1H3;2*3-6H,1-2H3;2-5H,1H3,(H,9,10);4*2-5H,1H3;31*1-2H3.
What are the key properties of 1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene?
1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene has a molecular weight of 2904.76 g/mol, XLogP of 63.59, 0 rotatable bonds, 1 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;1,6-dimethylindole;2,5-dimethyl-3H-isoindol-1-one;ethane;6-methyl-1H-benzimidazole;5-methyl-1,2-benzoxazole;5-methyl-1,3-benzoxazole;6-methyl-1,2-benzoxazole;6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indene;2-methylnaphthalene;7-methylquinoline;6-methyl-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 158144559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).