5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine

C36H32N2 — CID 58501433

IUPAC5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine
SMILESCc1ccc(N(c2ccc(C)cc2)c2ccc3c(c2)C(C)(C)c2cc4c5ccccc5n(C)c4cc2-3)cc1
InChIInChI=1S/C36H32N2/c1-23-10-14-25(15-11-23)38(26-16-12-24(2)13-17-26)27-18-19-28-30-22-35-31(21-33(30)36(3,4)32(28)20-27)29-8-6-7-9-34(29)37(35)5/h6-22H,1-5H3
InChIKeyODZOFXAIYWYRRK-UHFFFAOYSA-N
MW492.67 g/mol
LogP9.72
Rot. Bonds3

About 5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine

5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine (PubChem CID 58501433) has the molecular formula C36H32N2 and a molecular weight of 492.67 g/mol. Its IUPAC name is 5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine.

Molecular Properties

Compound Name5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine
PubChem CID58501433
Molecular FormulaC36H32N2
Molecular Weight492.67 g/mol
Exact Mass492.26
IUPAC Name5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine
SMILESCc1ccc(N(c2ccc(C)cc2)c2ccc3c(c2)C(C)(C)c2cc4c5ccccc5n(C)c4cc2-3)cc1
InChIInChI=1S/C36H32N2/c1-23-10-14-25(15-11-23)38(26-16-12-24(2)13-17-26)27-18-19-28-30-22-35-31(21-33(30)36(3,4)32(28)20-27)29-8-6-7-9-34(29)37(35)5/h6-22H,1-5H3
InChIKeyODZOFXAIYWYRRK-UHFFFAOYSA-N
XLogP9.72
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.67
LogP ≤ 59.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetrakis(4-methylphenyl)indeno[1,2-b]fluorene-2,8-diamine
CID 59800971
N-(9,9-dimethylfluoren-2-yl)-6-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9-methylcarbazol-3-yl]-9-methyl-N-phenylcarbazol-2-amine
CID 147401277
9,9-dimethyl-N,N-bis(4-methylphenyl)fluoren-2-amine
CID 11111910
7-carbazol-9-yl-N-[4-(3,5-dimethylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 134370655
N-[4-(1-adamantyl)phenyl]-N-[4-(2-bicyclo[2.2.1]heptanyl)phenyl]-5,11,11-trimethylindeno[1,2-b]carbazol-9-amine
CID 170543069
1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylnaphthalene-1,4-diamine;9,9-dimethyl-2-N,7-N-bis(4-methylphenyl)-2-N,7-N-diphenylfluorene-2,7-diamine;ethane;4-methyl-N-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]-N-phenylaniline;4-methyl-N-(4-methylphenyl)-N-phenylaniline
CID 160684370
7,7-dimethyl-5-phenyl-N,N-bis(4-phenylphenyl)indeno[2,1-b]carbazol-9-amine
CID 66805021
9,9-dimethyl-N-(4-methylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
CID 118146352
6-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;6-carbazol-9-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-3-amine
CID 159916730
7,7-dimethyl-N,5-diphenyl-N-(4-phenylphenyl)indeno[2,1-b]carbazol-9-amine
CID 66804881
1-N-(9,9-dimethylfluoren-3-yl)-1-N,4-N-bis(4-methylphenyl)-4-N-(9-phenylcarbazol-3-yl)benzene-1,4-diamine
CID 71249275
2-N,7-N-bis[4-(3,6-dimethylcarbazol-9-yl)phenyl]-9,9-dimethyl-2-N,7-N-diphenylfluorene-2,7-diamine
CID 58969350

Frequently Asked Questions

What is the IUPAC name of 5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine?
The IUPAC name of 5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine (CID 58501433) is 5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine.
What is the SMILES notation for 5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine?
The canonical SMILES for 5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine is Cc1ccc(N(c2ccc(C)cc2)c2ccc3c(c2)C(C)(C)c2cc4c5ccccc5n(C)c4cc2-3)cc1.
What is the InChIKey of 5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine?
The InChIKey is ODZOFXAIYWYRRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H32N2/c1-23-10-14-25(15-11-23)38(26-16-12-24(2)13-17-26)27-18-19-28-30-22-35-31(21-33(30)36(3,4)32(28)20-27)29-8-6-7-9-34(29)37(35)5/h6-22H,1-5H3.
What are the key properties of 5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine?
5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine has a molecular weight of 492.67 g/mol, XLogP of 9.72, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,11,11-trimethyl-N,N-bis(4-methylphenyl)indeno[1,2-b]carbazol-9-amine is sourced from PubChem (CID 58501433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).