9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole

C39H31N — CID 143485789

IUPAC9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole
SMILESCc1ccccc1-c1ccccc1C(C)c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C39H31N/c1-27-11-3-4-12-33(27)35-14-6-5-13-34(35)28(2)29-19-21-30(22-20-29)31-23-25-32(26-24-31)40-38-17-9-7-15-36(38)37-16-8-10-18-39(37)40/h3-26,28H,1-2H3
InChIKeyKZAQRSPQMQXWFX-UHFFFAOYSA-N
MW513.68 g/mol
LogP10.58
Rot. Bonds5

About 9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole

9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole (PubChem CID 143485789) has the molecular formula C39H31N and a molecular weight of 513.68 g/mol. Its IUPAC name is 9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole.

Molecular Properties

Compound Name9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole
PubChem CID143485789
Molecular FormulaC39H31N
Molecular Weight513.68 g/mol
Exact Mass513.25
IUPAC Name9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole
SMILESCc1ccccc1-c1ccccc1C(C)c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C39H31N/c1-27-11-3-4-12-33(27)35-14-6-5-13-34(35)28(2)29-19-21-30(22-20-29)31-23-25-32(26-24-31)40-38-17-9-7-15-36(38)37-16-8-10-18-39(37)40/h3-26,28H,1-2H3
InChIKeyKZAQRSPQMQXWFX-UHFFFAOYSA-N
XLogP10.58
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.68
LogP ≤ 510.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[3-(2-methylphenyl)-4-(1-naphthalen-2-ylethyl)phenyl]-9-phenylcarbazole
CID 154968536
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;ethane
CID 143126318
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole
CID 135323607
9-[4-[4-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041201
9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]carbazole;9-(3-carbazol-9-ylphenyl)carbazole;9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[3,5-di(carbazol-9-yl)phenyl]carbazole
CID 158559186
ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole
CID 143943145
9-[4-[2-[4-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041264
3-[4-methyl-3-[2-(1-phenanthren-9-ylethyl)phenyl]phenyl]-9-(3-phenylphenyl)carbazole
CID 167292993
9-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]carbazole
CID 58939501
9-(4-propan-2-ylphenyl)-3-[3-[9-[9-(4-propan-2-ylphenyl)carbazol-3-yl]carbazol-3-yl]carbazol-9-yl]carbazole
CID 71232684
9-phenyl-3-(9-phenylcarbazol-3-yl)-6-(2-propan-2-ylphenyl)carbazole
CID 123284746
N-[4-[4-(4-carbazol-9-ylphenyl)-2,5-dimethylphenyl]phenyl]-2-(2-methylphenyl)aniline
CID 118033701

Frequently Asked Questions

What is the IUPAC name of 9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole?
The IUPAC name of 9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole (CID 143485789) is 9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole.
What is the SMILES notation for 9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole?
The canonical SMILES for 9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole is Cc1ccccc1-c1ccccc1C(C)c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.
What is the InChIKey of 9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole?
The InChIKey is KZAQRSPQMQXWFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H31N/c1-27-11-3-4-12-33(27)35-14-6-5-13-34(35)28(2)29-19-21-30(22-20-29)31-23-25-32(26-24-31)40-38-17-9-7-15-36(38)37-16-8-10-18-39(37)40/h3-26,28H,1-2H3.
What are the key properties of 9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole?
9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole has a molecular weight of 513.68 g/mol, XLogP of 10.58, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole is sourced from PubChem (CID 143485789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).