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

C47H55N — CID 143943145

IUPACethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole
SMILESCC.CC.CC.CC.Cc1ccccc1-c1ccccc1CCc1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C39H31N.4C2H6/c1-28-10-2-4-12-34(28)35-13-5-3-11-32(35)23-20-29-18-21-30(22-19-29)31-24-26-33(27-25-31)40-38-16-8-6-14-36(38)37-15-7-9-17-39(37)40;4*1-2/h2-19,21-22,24-27H,20,23H2,1H3;4*1-2H3
InChIKeyJCXPLEQPWLPKLN-UHFFFAOYSA-N
MW633.96 g/mol
LogP14.32
Rot. Bonds6

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

ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole (PubChem CID 143943145) has the molecular formula C47H55N and a molecular weight of 633.96 g/mol. Its IUPAC name is ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole.

Molecular Properties

Compound Nameethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole
PubChem CID143943145
Molecular FormulaC47H55N
Molecular Weight633.96 g/mol
Exact Mass633.43
IUPAC Nameethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole
SMILESCC.CC.CC.CC.Cc1ccccc1-c1ccccc1CCc1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C39H31N.4C2H6/c1-28-10-2-4-12-34(28)35-13-5-3-11-32(35)23-20-29-18-21-30(22-19-29)31-24-26-33(27-25-31)40-38-16-8-6-14-36(38)37-15-7-9-17-39(37)40;4*1-2/h2-19,21-22,24-27H,20,23H2,1H3;4*1-2H3
InChIKeyJCXPLEQPWLPKLN-UHFFFAOYSA-N
XLogP14.32
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500633.96
LogP ≤ 514.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole 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-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;ethane
CID 143126318
4-(2-methylphenyl)-9-(4-phenylphenyl)-3-[(4-phenylphenyl)methyl]carbazole
CID 177063531
9-[4-[4-[1-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole
CID 143485789
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
3-[3-[2-[2-(3-dibenzofuran-2-ylphenyl)ethyl]phenyl]-4-methylphenyl]-9-phenylcarbazole
CID 126760057
N-[4-(4-carbazol-9-ylphenyl)phenyl]-2-(2-propylphenyl)aniline
CID 166895085
9-[4-[4-[3-(4-phenylphenyl)-3-[4-(4-phenylphenyl)phenyl]propyl]phenyl]phenyl]carbazole
CID 156568545
9-[4-[2-[4-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041264
3-[3-(2-methylphenyl)-4-[(3-phenylphenyl)methyl]phenyl]-9-(3-phenylphenyl)carbazole
CID 166804730
[9-[4-[4-[3-(hydroxymethyl)carbazol-9-yl]phenyl]phenyl]carbazol-3-yl]methanol
CID 58625620
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

Frequently Asked Questions

What is the IUPAC name of ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole?
The IUPAC name of ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole (CID 143943145) is ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole.
What is the SMILES notation for ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole?
The canonical SMILES for ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole is CC.CC.CC.CC.Cc1ccccc1-c1ccccc1CCc1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.
What is the InChIKey of ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole?
The InChIKey is JCXPLEQPWLPKLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H31N.4C2H6/c1-28-10-2-4-12-34(28)35-13-5-3-11-32(35)23-20-29-18-21-30(22-19-29)31-24-26-33(27-25-31)40-38-16-8-6-14-36(38)37-15-7-9-17-39(37)40;4*1-2/h2-19,21-22,24-27H,20,23H2,1H3;4*1-2H3.
What are the key properties of ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole?
ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole has a molecular weight of 633.96 g/mol, XLogP of 14.32, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;9-[4-[4-[2-[2-(2-methylphenyl)phenyl]ethyl]phenyl]phenyl]carbazole is sourced from PubChem (CID 143943145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).