2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline

C31H24N2 — CID 144884258

IUPAC2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline
SMILESCn1c2ccccc2c2cc(-c3ccccc3Nc3ccc(-c4ccccc4)cc3)ccc21
InChIInChI=1S/C31H24N2/c1-33-30-14-8-6-12-27(30)28-21-24(17-20-31(28)33)26-11-5-7-13-29(26)32-25-18-15-23(16-19-25)22-9-3-2-4-10-22/h2-21,32H,1H3
InChIKeyRBLJHLCVUNFCEB-UHFFFAOYSA-N
MW424.55 g/mol
LogP8.41
Rot. Bonds4

About 2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline

2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline (PubChem CID 144884258) has the molecular formula C31H24N2 and a molecular weight of 424.55 g/mol. Its IUPAC name is 2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound Name2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline
PubChem CID144884258
Molecular FormulaC31H24N2
Molecular Weight424.55 g/mol
Exact Mass424.19
IUPAC Name2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline
SMILESCn1c2ccccc2c2cc(-c3ccccc3Nc3ccc(-c4ccccc4)cc3)ccc21
InChIInChI=1S/C31H24N2/c1-33-30-14-8-6-12-27(30)28-21-24(17-20-31(28)33)26-11-5-7-13-29(26)32-25-18-15-23(16-19-25)22-9-3-2-4-10-22/h2-21,32H,1H3
InChIKeyRBLJHLCVUNFCEB-UHFFFAOYSA-N
XLogP8.41
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.55
LogP ≤ 58.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-phenyl-2-[3-[9-(3-phenylphenyl)carbazol-3-yl]phenyl]aniline
CID 118907859
9-methyl-3-(9-methylcarbazol-3-yl)-6-(4-phenylphenyl)carbazole
CID 134359342
5-carbazol-9-yl-2-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)aniline
CID 163631547
2-naphthalen-2-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;3-naphthalen-2-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;N-(4-naphthalen-2-ylphenyl)-2-(9-phenylcarbazol-3-yl)aniline;N-(4-naphthalen-2-ylphenyl)-3-(9-phenylcarbazol-3-yl)aniline
CID 158992655
2-(4-phenylphenyl)-N-[4-[4-[2-(4-phenylphenyl)anilino]phenyl]phenyl]aniline
CID 69449342
9-methylcarbazole;9-methyl-3,6-diphenylcarbazole;9-methyl-3-(2-methylphenyl)carbazole;9-methyl-3-(4-methylphenyl)carbazole;9-methyl-3-phenylcarbazole
CID 157294654
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
2-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 121360373
2-phenyl-N-[4-[4-(4-phenylanilino)phenyl]phenyl]aniline
CID 118616888
2-[3-[4-(4-anilinophenyl)anilino]phenyl]-N-phenylaniline
CID 118176553
1-N-phenyl-4-N-[4-(9-phenylcarbazol-3-yl)phenyl]-2-(4-phenylphenyl)benzene-1,4-diamine
CID 175396320
9-methyl-3-[3-[9-(9-methyl-6-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]-6-phenylcarbazole
CID 71232675

Frequently Asked Questions

What is the IUPAC name of 2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline?
The IUPAC name of 2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline (CID 144884258) is 2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline.
What is the SMILES notation for 2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline?
The canonical SMILES for 2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline is Cn1c2ccccc2c2cc(-c3ccccc3Nc3ccc(-c4ccccc4)cc3)ccc21.
What is the InChIKey of 2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline?
The InChIKey is RBLJHLCVUNFCEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24N2/c1-33-30-14-8-6-12-27(30)28-21-24(17-20-31(28)33)26-11-5-7-13-29(26)32-25-18-15-23(16-19-25)22-9-3-2-4-10-22/h2-21,32H,1H3.
What are the key properties of 2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline?
2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline has a molecular weight of 424.55 g/mol, XLogP of 8.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9-methylcarbazol-3-yl)-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 144884258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).