ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine

C122H182N18 — CID 162043238

About ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine

ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine (PubChem CID 162043238) has the molecular formula C122H182N18 and a molecular weight of 1900.92 g/mol. Its IUPAC name is ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine.

Molecular Properties

• Compound Name: ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine
• PubChem CID: 162043238
• Molecular Formula: C122H182N18
• Molecular Weight: 1900.92 g/mol
• Exact Mass: 1899.48
• IUPAC Name: ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine
• SMILES: CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC1=C(C)c2c(C)cccc2C1.CC1=C(C)c2c(C)ccnc2C1.CC1=C(C)c2c(C)cncc2C1.CC1=C(C)c2c(ccnc2C)C1.Cc1cccc2nc(C)n(C)c12.Cc1ccnc2cc(C)n(C)c12.Cc1ccnc2nc(C)n(C)c12.Cc1cncc2cc(C)n(C)c12.Cc1cncc2nc(C)n(C)c12.Cc1nccc2nc(C)n(C)c12
• InChI: InChI=1S/C12H14.3C11H13N.3C10H12N2.3C9H11N3.10C2H6/c1-8-5-4-6-11-7-9(2)10(3)12(8)11;1-7-4-10-6-12-5-8(2)11(10)9(7)3;1-7-6-10-4-5-12-9(3)11(10)8(7)2;1-7-4-5-12-10-6-8(2)9(3)11(7)10;1-7-5-11-6-9-4-8(2)12(3)10(7)9;1-7-4-5-11-9-6-8(2)12(3)10(7)9;1-7-5-4-6-9-10(7)12(3)8(2)11-9;1-6-4-10-5-8-9(6)12(3)7(2)11-8;1-6-9-8(4-5-10-6)11-7(2)12(9)3;1-6-4-5-10-9-8(6)12(3)7(2)11-9;10*1-2/h4-6H,7H2,1-3H3;5-6H,4H2,1-3H3;2*4-5H,6H2,1-3H3;3*4-6H,1-3H3;3*4-5H,1-3H3;10*1-2H3
• InChIKey: YXOBLXJJDWSARN-UHFFFAOYSA-N
• XLogP: 33.15
• TPSA: 184.26 Ų
• H-Bond Acceptors: 18
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1900.92
LogP ≤ 5	33.15
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine?

The IUPAC name of ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine (CID 162043238) is ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine.

What is the SMILES notation for ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine?

The canonical SMILES for ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC1=C(C)c2c(C)cccc2C1.CC1=C(C)c2c(C)ccnc2C1.CC1=C(C)c2c(C)cncc2C1.CC1=C(C)c2c(ccnc2C)C1.Cc1cccc2nc(C)n(C)c12.Cc1ccnc2cc(C)n(C)c12.Cc1ccnc2nc(C)n(C)c12.Cc1cncc2cc(C)n(C)c12.Cc1cncc2nc(C)n(C)c12.Cc1nccc2nc(C)n(C)c12.

What is the InChIKey of ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine?

The InChIKey is YXOBLXJJDWSARN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14.3C11H13N.3C10H12N2.3C9H11N3.10C2H6/c1-8-5-4-6-11-7-9(2)10(3)12(8)11;1-7-4-10-6-12-5-8(2)11(10)9(7)3;1-7-6-10-4-5-12-9(3)11(10)8(7)2;1-7-4-5-12-10-6-8(2)9(3)11(7)10;1-7-5-11-6-9-4-8(2)12(3)10(7)9;1-7-4-5-11-9-6-8(2)12(3)10(7)9;1-7-5-4-6-9-10(7)12(3)8(2)11-9;1-6-4-10-5-8-9(6)12(3)7(2)11-8;1-6-9-8(4-5-10-6)11-7(2)12(9)3;1-6-4-5-10-9-8(6)12(3)7(2)11-9;10*1-2/h4-6H,7H2,1-3H3;5-6H,4H2,1-3H3;2*4-5H,6H2,1-3H3;3*4-6H,1-3H3;3*4-5H,1-3H3;10*1-2H3.

What are the key properties of ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine?

ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine has a molecular weight of 1900.92 g/mol, XLogP of 33.15, 0 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for ethane;1,2,7-trimethylbenzimidazole;4,5,6-trimethyl-7H-cyclopenta[b]pyridine;1,6,7-trimethyl-5H-cyclopenta[c]pyridine;4,5,6-trimethyl-7H-cyclopenta[c]pyridine;1,2,7-trimethylimidazo[4,5-b]pyridine;1,2,7-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethylimidazo[4,5-c]pyridine;2,3,4-trimethyl-1H-indene;1,2,7-trimethylpyrrolo[3,2-b]pyridine;1,2,7-trimethylpyrrolo[3,2-c]pyridine is sourced from PubChem (CID 162043238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).