9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole

C30H28N2 — CID 170205010

IUPAC9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole
SMILESCC(C)n1c2ccccc2c2ccc(-c3ccc4c5ccccc5n(C(C)C)c4c3)cc21
InChIInChI=1S/C30H28N2/c1-19(2)31-27-11-7-5-9-23(27)25-15-13-21(17-29(25)31)22-14-16-26-24-10-6-8-12-28(24)32(20(3)4)30(26)18-22/h5-20H,1-4H3
InChIKeyAMBNTTLVCFZVJG-UHFFFAOYSA-N
MW416.57 g/mol
LogP8.73
Rot. Bonds3

About 9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole

9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole (PubChem CID 170205010) has the molecular formula C30H28N2 and a molecular weight of 416.57 g/mol. Its IUPAC name is 9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole.

Molecular Properties

Compound Name9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole
PubChem CID170205010
Molecular FormulaC30H28N2
Molecular Weight416.57 g/mol
Exact Mass416.23
IUPAC Name9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole
SMILESCC(C)n1c2ccccc2c2ccc(-c3ccc4c5ccccc5n(C(C)C)c4c3)cc21
InChIInChI=1S/C30H28N2/c1-19(2)31-27-11-7-5-9-23(27)25-15-13-21(17-29(25)31)22-14-16-26-24-10-6-8-12-28(24)32(20(3)4)30(26)18-22/h5-20H,1-4H3
InChIKeyAMBNTTLVCFZVJG-UHFFFAOYSA-N
XLogP8.73
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.57
LogP ≤ 58.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(9-phenylcarbazol-2-yl)-9-propan-2-ylcarbazole
CID 134236460
ethane;(2Z,4Z)-hexa-2,4-diene;9-propan-2-ylcarbazole
CID 165044718
9-propan-2-ylcarbazole-3-carbaldehyde
CID 16762077
9-[10-(3-phenylphenyl)anthracen-9-yl]-7-propan-2-ylbenzo[c]carbazole
CID 176777720
11-propan-2-ylbenzo[a]carbazole
CID 118058944
3-(5a,9a-dihydrodibenzothiophen-2-yl)-9-propan-2-ylcarbazole
CID 164832563
3,5-dinitrobenzoic acid;9-propan-2-ylcarbazole
CID 139057652
9-methyl-3-(9-methylcarbazol-2-yl)-6-phenylcarbazole;9-methyl-3-(9-methylcarbazol-3-yl)-6-phenylcarbazole;9-methyl-3-(9-methylcarbazol-3-yl)-6-(4-phenylphenyl)carbazole
CID 157228450
N-methoxy-1-(9-propan-2-ylcarbazol-3-yl)methanamine
CID 117424797
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
9-ethyl-2-[7-(9-ethylcarbazol-2-yl)triphenylen-2-yl]carbazole
CID 141303114
3-(4-carbazol-9-ylphenyl)-5,11-diphenylindolo[3,2-b]carbazole
CID 134194444

Frequently Asked Questions

What is the IUPAC name of 9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole?
The IUPAC name of 9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole (CID 170205010) is 9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole.
What is the SMILES notation for 9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole?
The canonical SMILES for 9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole is CC(C)n1c2ccccc2c2ccc(-c3ccc4c5ccccc5n(C(C)C)c4c3)cc21.
What is the InChIKey of 9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole?
The InChIKey is AMBNTTLVCFZVJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28N2/c1-19(2)31-27-11-7-5-9-23(27)25-15-13-21(17-29(25)31)22-14-16-26-24-10-6-8-12-28(24)32(20(3)4)30(26)18-22/h5-20H,1-4H3.
What are the key properties of 9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole?
9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole has a molecular weight of 416.57 g/mol, XLogP of 8.73, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole is sourced from PubChem (CID 170205010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).