3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole

C33H26N2 — CID 134236460

IUPAC3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole
SMILESCC(C)n1c2ccccc2c2cc(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)ccc21
InChIInChI=1S/C33H26N2/c1-22(2)34-30-14-8-7-13-27(30)29-20-23(17-19-32(29)34)24-16-18-28-26-12-6-9-15-31(26)35(33(28)21-24)25-10-4-3-5-11-25/h3-22H,1-2H3
InChIKeyMREVPFSCPOIAGL-UHFFFAOYSA-N
MW450.59 g/mol
LogP9.14
Rot. Bonds3

About 3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole

3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole (PubChem CID 134236460) has the molecular formula C33H26N2 and a molecular weight of 450.59 g/mol. Its IUPAC name is 3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole.

Molecular Properties

Compound Name3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole
PubChem CID134236460
Molecular FormulaC33H26N2
Molecular Weight450.59 g/mol
Exact Mass450.21
IUPAC Name3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole
SMILESCC(C)n1c2ccccc2c2cc(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)ccc21
InChIInChI=1S/C33H26N2/c1-22(2)34-30-14-8-7-13-27(30)29-20-23(17-19-32(29)34)24-16-18-28-26-12-6-9-15-31(26)35(33(28)21-24)25-10-4-3-5-11-25/h3-22H,1-2H3
InChIKeyMREVPFSCPOIAGL-UHFFFAOYSA-N
XLogP9.14
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.59
LogP ≤ 59.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(9-phenylcarbazol-2-yl)-9-[4-[2-[9-[4-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazole
CID 137420846
2-(6,9-diphenylcarbazol-3-yl)-6,9-diphenylcarbazole;3,9-diphenyl-6-(9-phenylcarbazol-2-yl)carbazole;9-phenyl-3-(9-phenylcarbazol-2-yl)-6-(4-phenylphenyl)carbazole
CID 161163873
3,6-diphenyl-9-[4-(9-phenylcarbazol-2-yl)phenyl]carbazole
CID 118084405
6-(4-carbazol-9-ylphenyl)-2,9-diphenylcarbazole
CID 126682018
6-(9-phenylcarbazol-3-yl)-2,9-bis(4-phenylphenyl)carbazole
CID 137400811
2,7-diphenyl-9-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 166037407
2-[9-(4-methylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 135248578
9-phenyl-2-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 129225606
5,11-diphenyl-2-triphenylen-2-ylindolo[3,2-b]carbazole
CID 90441162
9-(4-phenylphenyl)-2-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 121285556
2-phenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 170072600
6-(7,9-diphenylcarbazol-3-yl)-2,9-diphenylcarbazole
CID 121262585

Frequently Asked Questions

What is the IUPAC name of 3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole?
The IUPAC name of 3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole (CID 134236460) is 3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole.
What is the SMILES notation for 3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole?
The canonical SMILES for 3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole is CC(C)n1c2ccccc2c2cc(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)ccc21.
What is the InChIKey of 3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole?
The InChIKey is MREVPFSCPOIAGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26N2/c1-22(2)34-30-14-8-7-13-27(30)29-20-23(17-19-32(29)34)24-16-18-28-26-12-6-9-15-31(26)35(33(28)21-24)25-10-4-3-5-11-25/h3-22H,1-2H3.
What are the key properties of 3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole?
3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole has a molecular weight of 450.59 g/mol, XLogP of 9.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole is sourced from PubChem (CID 134236460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).