2,6,9-tritert-butylcarbazole

C24H33N — CID 177113514

IUPAC2,6,9-tritert-butylcarbazole
SMILESCC(C)(C)c1ccc2c(c1)c1ccc(C(C)(C)C)cc1n2C(C)(C)C
InChIInChI=1S/C24H33N/c1-22(2,3)16-11-13-20-19(14-16)18-12-10-17(23(4,5)6)15-21(18)25(20)24(7,8)9/h10-15H,1-9H3
InChIKeyOVZSLPGWXNANEF-UHFFFAOYSA-N
MW335.54 g/mol
LogP7.14
Rot. Bonds

About 2,6,9-tritert-butylcarbazole

2,6,9-tritert-butylcarbazole (PubChem CID 177113514) has the molecular formula C24H33N and a molecular weight of 335.54 g/mol. Its IUPAC name is 2,6,9-tritert-butylcarbazole.

Molecular Properties

Compound Name2,6,9-tritert-butylcarbazole
PubChem CID177113514
Molecular FormulaC24H33N
Molecular Weight335.54 g/mol
Exact Mass335.26
IUPAC Name2,6,9-tritert-butylcarbazole
SMILESCC(C)(C)c1ccc2c(c1)c1ccc(C(C)(C)C)cc1n2C(C)(C)C
InChIInChI=1S/C24H33N/c1-22(2,3)16-11-13-20-19(14-16)18-12-10-17(23(4,5)6)15-21(18)25(20)24(7,8)9/h10-15H,1-9H3
InChIKeyOVZSLPGWXNANEF-UHFFFAOYSA-N
XLogP7.14
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.54
LogP ≤ 57.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2,6,9-tritert-butylcarbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-tert-butylcarbazole;2-tert-butyl-9-phenylcarbazole;3-tert-butyl-9-phenylcarbazole;9-(3-tert-butylphenyl)carbazole
CID 160742117
6,11,18,23-tetratert-butyl-2,14-diazaheptacyclo[12.10.1.12,9.03,8.015,20.021,25.013,26]hexacosa-1(24),3(8),4,6,9(26),10,12,15(20),16,18,21(25),22-dodecaene
CID 171595251
2,7-ditert-butyl-9-[7-tert-butyl-9-[4-[2-[4-[2-tert-butyl-6-(2,7-ditert-butylcarbazol-9-yl)carbazol-9-yl]phenyl]propan-2-yl]phenyl]carbazol-3-yl]carbazole
CID 176617143
9-tert-butyl-2-fluorocarbazole
CID 177283340
9-tert-butylcarbazole;9-(3-tert-butyl-5-carbazol-9-ylphenyl)carbazole;2-tert-butyl-9-phenylcarbazole;3-tert-butyl-9-phenylcarbazole;9-(3-tert-butylphenyl)carbazole;3-(3-tert-butylphenyl)-9-(4-phenylphenyl)carbazole
CID 159174538
5,10-ditert-butyl-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 102489233
5-tert-butyl-3-chloro-1-methylindazole
CID 169058983
2,7-ditert-butyl-9-(2,3,5,6-tetramethylheptan-4-yl)carbazole
CID 155180694
3,9-ditert-butylisoindolo[2,1-a]quinoline
CID 159003286
5-tert-butyl-1,3-dimethylindole
CID 82491537
2,7-ditert-butyl-9-(2,7-ditert-butylphenanthren-9-yl)phenanthrene
CID 123877985
3,6-ditert-butyl-9-(3-carbazol-9-ylphenyl)carbazole
CID 59399108

Frequently Asked Questions

What is the IUPAC name of 2,6,9-tritert-butylcarbazole?
The IUPAC name of 2,6,9-tritert-butylcarbazole (CID 177113514) is 2,6,9-tritert-butylcarbazole.
What is the SMILES notation for 2,6,9-tritert-butylcarbazole?
The canonical SMILES for 2,6,9-tritert-butylcarbazole is CC(C)(C)c1ccc2c(c1)c1ccc(C(C)(C)C)cc1n2C(C)(C)C.
What is the InChIKey of 2,6,9-tritert-butylcarbazole?
The InChIKey is OVZSLPGWXNANEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N/c1-22(2,3)16-11-13-20-19(14-16)18-12-10-17(23(4,5)6)15-21(18)25(20)24(7,8)9/h10-15H,1-9H3.
What are the key properties of 2,6,9-tritert-butylcarbazole?
2,6,9-tritert-butylcarbazole has a molecular weight of 335.54 g/mol, XLogP of 7.14, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,9-tritert-butylcarbazole is sourced from PubChem (CID 177113514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).