9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline

C124H161N5 — CID 159661301

IUPAC9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline
SMILESCC(C)(C)c1cc(N(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)C(C)(C)C)cc(C(C)(C)C)c1.CC(C)(C)c1ccc(N(c2ccc(C(C)(C)C)cc2)C(C)(C)C)cc1.CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2C(C)(C)C.CC(C)(C)n1c2ccc(-c3ccccc3)cc2c2cc(-c3ccccc3)ccc21.CC(C)(C)n1c2ccccc2c2ccccc21
InChIInChI=1S/C32H51N.C28H25N.C24H33N.C24H35N.C16H17N/c1-28(2,3)22-16-23(29(4,5)6)19-26(18-22)33(32(13,14)15)27-20-24(30(7,8)9)17-25(21-27)31(10,11)12;1-28(2,3)29-26-16-14-22(20-10-6-4-7-11-20)18-24(26)25-19-23(15-17-27(25)29)21-12-8-5-9-13-21;1-22(2,3)16-10-12-20-18(14-16)19-15-17(23(4,5)6)11-13-21(19)25(20)24(7,8)9;1-22(2,3)18-10-14-20(15-11-18)25(24(7,8)9)21-16-12-19(13-17-21)23(4,5)6;1-16(2,3)17-14-10-6-4-8-12(14)13-9-5-7-11-15(13)17/h16-21H,1-15H3;4-19H,1-3H3;10-15H,1-9H3;10-17H,1-9H3;4-11H,1-3H3
InChIKeyMSVNAYCNEVSKNC-UHFFFAOYSA-N
MW1721.69 g/mol
LogP36.61
Rot. Bonds6

About 9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline

9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline (PubChem CID 159661301) has the molecular formula C124H161N5 and a molecular weight of 1721.69 g/mol. Its IUPAC name is 9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline.

Molecular Properties

Compound Name9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline
PubChem CID159661301
Molecular FormulaC124H161N5
Molecular Weight1721.69 g/mol
Exact Mass1720.28
IUPAC Name9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline
SMILESCC(C)(C)c1cc(N(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)C(C)(C)C)cc(C(C)(C)C)c1.CC(C)(C)c1ccc(N(c2ccc(C(C)(C)C)cc2)C(C)(C)C)cc1.CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2C(C)(C)C.CC(C)(C)n1c2ccc(-c3ccccc3)cc2c2cc(-c3ccccc3)ccc21.CC(C)(C)n1c2ccccc2c2ccccc21
InChIInChI=1S/C32H51N.C28H25N.C24H33N.C24H35N.C16H17N/c1-28(2,3)22-16-23(29(4,5)6)19-26(18-22)33(32(13,14)15)27-20-24(30(7,8)9)17-25(21-27)31(10,11)12;1-28(2,3)29-26-16-14-22(20-10-6-4-7-11-20)18-24(26)25-19-23(15-17-27(25)29)21-12-8-5-9-13-21;1-22(2,3)16-10-12-20-18(14-16)19-15-17(23(4,5)6)11-13-21(19)25(20)24(7,8)9;1-22(2,3)18-10-14-20(15-11-18)25(24(7,8)9)21-16-12-19(13-17-21)23(4,5)6;1-16(2,3)17-14-10-6-4-8-12(14)13-9-5-7-11-15(13)17/h16-21H,1-15H3;4-19H,1-3H3;10-15H,1-9H3;10-17H,1-9H3;4-11H,1-3H3
InChIKeyMSVNAYCNEVSKNC-UHFFFAOYSA-N
XLogP36.61
TPSA21.27 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms129
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001721.69
LogP ≤ 536.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline with MolForge

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Related Compounds

9-tert-butyl-3-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]carbazole;9-tert-butyl-3-[4-[10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]carbazole
CID 161436375
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
N-(4-tert-butylphenyl)-4-[9-(4-tert-butylphenyl)carbazol-3-yl]-N-phenylaniline
CID 143859069
N-tert-butyl-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 177281311
N-tert-butyl-9-(4-tert-butylphenyl)-N-(4-fluorophenyl)carbazol-3-amine
CID 162698374
9-[4-(4-tert-butylphenyl)phenyl]-2-(4-methylphenyl)-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 170073064
2-tert-butyl-9-phenylcarbazole;3-tert-butyl-9-phenylcarbazole;3-tert-butyl-9-(9-phenylcarbazol-3-yl)carbazole;9-(4-tert-butylphenyl)-3-carbazol-9-ylcarbazole;3-tert-butyl-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole
CID 159742903
N,4-ditert-butyl-N-phenylaniline
CID 91172141
N-[4-[9-(4-tert-butylphenyl)carbazol-3-yl]phenyl]-9,10-dimethyl-N-(4-phenylphenyl)phenanthren-2-amine
CID 135248487
9-tert-butylcarbazole;9-tert-butyl-3-carbazol-9-ylcarbazole;3-(9-tert-butylcarbazol-3-yl)-9-phenylcarbazole;9-tert-butyl-3,6-di(carbazol-9-yl)carbazole
CID 164959111
3-[9-[3-[3-(4-tert-butylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 167259635
9-(3-tert-butylphenyl)-3-[9-(3-tert-butylphenyl)carbazol-3-yl]carbazole;9-(4-tert-butylphenyl)-3-[9-(4-tert-butylphenyl)carbazol-3-yl]carbazole;N,N-diphenyl-3-[3-[9-[3-(N-phenylanilino)phenyl]carbazol-3-yl]carbazol-9-yl]aniline;N,N-diphenyl-4-[3-[9-[4-(N-phenylanilino)phenyl]carbazol-3-yl]carbazol-9-yl]aniline
CID 161395896

Frequently Asked Questions

What is the IUPAC name of 9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline?
The IUPAC name of 9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline (CID 159661301) is 9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline.
What is the SMILES notation for 9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline?
The canonical SMILES for 9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline is CC(C)(C)c1cc(N(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)C(C)(C)C)cc(C(C)(C)C)c1.CC(C)(C)c1ccc(N(c2ccc(C(C)(C)C)cc2)C(C)(C)C)cc1.CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2C(C)(C)C.CC(C)(C)n1c2ccc(-c3ccccc3)cc2c2cc(-c3ccccc3)ccc21.CC(C)(C)n1c2ccccc2c2ccccc21.
What is the InChIKey of 9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline?
The InChIKey is MSVNAYCNEVSKNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H51N.C28H25N.C24H33N.C24H35N.C16H17N/c1-28(2,3)22-16-23(29(4,5)6)19-26(18-22)33(32(13,14)15)27-20-24(30(7,8)9)17-25(21-27)31(10,11)12;1-28(2,3)29-26-16-14-22(20-10-6-4-7-11-20)18-24(26)25-19-23(15-17-27(25)29)21-12-8-5-9-13-21;1-22(2,3)16-10-12-20-18(14-16)19-15-17(23(4,5)6)11-13-21(19)25(20)24(7,8)9;1-22(2,3)18-10-14-20(15-11-18)25(24(7,8)9)21-16-12-19(13-17-21)23(4,5)6;1-16(2,3)17-14-10-6-4-8-12(14)13-9-5-7-11-15(13)17/h16-21H,1-15H3;4-19H,1-3H3;10-15H,1-9H3;10-17H,1-9H3;4-11H,1-3H3.
What are the key properties of 9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline?
9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline has a molecular weight of 1721.69 g/mol, XLogP of 36.61, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-tert-butylcarbazole;9-tert-butyl-3,6-diphenylcarbazole;N,4-ditert-butyl-N-(4-tert-butylphenyl)aniline;3,6,9-tritert-butylcarbazole;N,3,5-tritert-butyl-N-(3,5-ditert-butylphenyl)aniline is sourced from PubChem (CID 159661301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).