2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine

C105H105N7 — CID 158997059

IUPAC2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine
SMILESCc1ccc2c(c1)-c1cccnc1C2(C)C.Cc1ccc2c(c1)C(C)(C)c1ncccc1-2.Cc1ccc2c(n1)C(C)(C)c1ccccc1-2.Cc1cccc2c1-c1cccnc1C2(C)C.Cc1cccc2c1C(C)(C)c1ncccc1-2.Cc1ccnc2c1-c1ccccc1C2(C)C.Cc1cnc2c(c1)-c1ccccc1C2(C)C
InChIInChI=1S/7C15H15N/c1-10-6-4-8-12-13(10)11-7-5-9-16-14(11)15(12,2)3;1-10-6-4-7-11-12-8-5-9-16-14(12)15(2,3)13(10)11;1-10-6-7-11-12-5-4-8-16-14(12)15(2,3)13(11)9-10;1-10-6-7-13-12(9-10)11-5-4-8-16-14(11)15(13,2)3;1-10-8-12-11-6-4-5-7-13(11)15(2,3)14(12)16-9-10;1-10-8-9-12-11-6-4-5-7-13(11)15(2,3)14(12)16-10;1-10-8-9-16-14-13(10)11-6-4-5-7-12(11)15(14,2)3/h7*4-9H,1-3H3
InChIKeyJQWCMBWEBQYASY-UHFFFAOYSA-N
MW1465.04 g/mol
LogP25.87
Rot. Bonds

About 2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine

2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine (PubChem CID 158997059) has the molecular formula C105H105N7 and a molecular weight of 1465.04 g/mol. Its IUPAC name is 2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine.

Molecular Properties

Compound Name2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine
PubChem CID158997059
Molecular FormulaC105H105N7
Molecular Weight1465.04 g/mol
Exact Mass1463.84
IUPAC Name2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine
SMILESCc1ccc2c(c1)-c1cccnc1C2(C)C.Cc1ccc2c(c1)C(C)(C)c1ncccc1-2.Cc1ccc2c(n1)C(C)(C)c1ccccc1-2.Cc1cccc2c1-c1cccnc1C2(C)C.Cc1cccc2c1C(C)(C)c1ncccc1-2.Cc1ccnc2c1-c1ccccc1C2(C)C.Cc1cnc2c(c1)-c1ccccc1C2(C)C
InChIInChI=1S/7C15H15N/c1-10-6-4-8-12-13(10)11-7-5-9-16-14(11)15(12,2)3;1-10-6-4-7-11-12-8-5-9-16-14(12)15(2,3)13(10)11;1-10-6-7-11-12-5-4-8-16-14(12)15(2,3)13(11)9-10;1-10-6-7-13-12(9-10)11-5-4-8-16-14(11)15(13,2)3;1-10-8-12-11-6-4-5-7-13(11)15(2,3)14(12)16-9-10;1-10-8-9-12-11-6-4-5-7-13(11)15(2,3)14(12)16-10;1-10-8-9-16-14-13(10)11-6-4-5-7-12(11)15(14,2)3/h7*4-9H,1-3H3
InChIKeyJQWCMBWEBQYASY-UHFFFAOYSA-N
XLogP25.87
TPSA90.23 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms112
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001465.04
LogP ≤ 525.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine?
The IUPAC name of 2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine (CID 158997059) is 2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine.
What is the SMILES notation for 2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine?
The canonical SMILES for 2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine is Cc1ccc2c(c1)-c1cccnc1C2(C)C.Cc1ccc2c(c1)C(C)(C)c1ncccc1-2.Cc1ccc2c(n1)C(C)(C)c1ccccc1-2.Cc1cccc2c1-c1cccnc1C2(C)C.Cc1cccc2c1C(C)(C)c1ncccc1-2.Cc1ccnc2c1-c1ccccc1C2(C)C.Cc1cnc2c(c1)-c1ccccc1C2(C)C.
What is the InChIKey of 2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine?
The InChIKey is JQWCMBWEBQYASY-UHFFFAOYSA-N. The full InChI is InChI=1S/7C15H15N/c1-10-6-4-8-12-13(10)11-7-5-9-16-14(11)15(12,2)3;1-10-6-4-7-11-12-8-5-9-16-14(12)15(2,3)13(10)11;1-10-6-7-11-12-5-4-8-16-14(12)15(2,3)13(11)9-10;1-10-6-7-13-12(9-10)11-5-4-8-16-14(11)15(13,2)3;1-10-8-12-11-6-4-5-7-13(11)15(2,3)14(12)16-9-10;1-10-8-9-12-11-6-4-5-7-13(11)15(2,3)14(12)16-10;1-10-8-9-16-14-13(10)11-6-4-5-7-12(11)15(14,2)3/h7*4-9H,1-3H3.
What are the key properties of 2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine?
2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine has a molecular weight of 1465.04 g/mol, XLogP of 25.87, 0 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,9,9-trimethylindeno[2,1-b]pyridine;3,9,9-trimethylindeno[2,1-b]pyridine;4,9,9-trimethylindeno[2,1-b]pyridine;5,9,9-trimethylindeno[2,1-b]pyridine;6,9,9-trimethylindeno[2,1-b]pyridine;7,9,9-trimethylindeno[2,1-b]pyridine;8,9,9-trimethylindeno[2,1-b]pyridine is sourced from PubChem (CID 158997059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).