9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine

C31H24N2 — CID 129125677

IUPAC9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine
SMILESCc1ccc(-n2c3ccccc3c3cc(-c4ccccc4)c(Nc4ccccc4)cc32)cc1
InChIInChI=1S/C31H24N2/c1-22-16-18-25(19-17-22)33-30-15-9-8-14-26(30)28-20-27(23-10-4-2-5-11-23)29(21-31(28)33)32-24-12-6-3-7-13-24/h2-21,32H,1H3
InChIKeyXZMSFWBYRHNNLR-UHFFFAOYSA-N
MW424.55 g/mol
LogP8.50
Rot. Bonds4

About 9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine

9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine (PubChem CID 129125677) has the molecular formula C31H24N2 and a molecular weight of 424.55 g/mol. Its IUPAC name is 9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine.

Molecular Properties

Compound Name9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine
PubChem CID129125677
Molecular FormulaC31H24N2
Molecular Weight424.55 g/mol
Exact Mass424.19
IUPAC Name9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine
SMILESCc1ccc(-n2c3ccccc3c3cc(-c4ccccc4)c(Nc4ccccc4)cc32)cc1
InChIInChI=1S/C31H24N2/c1-22-16-18-25(19-17-22)33-30-15-9-8-14-26(30)28-20-27(23-10-4-2-5-11-23)29(21-31(28)33)32-24-12-6-3-7-13-24/h2-21,32H,1H3
InChIKeyXZMSFWBYRHNNLR-UHFFFAOYSA-N
XLogP8.50
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 ≤ 58.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-carbazol-9-yl-N,2-diphenylaniline
CID 121360313
1-N,3-N-diphenyl-4,6-bis(9-phenylcarbazol-3-yl)benzene-1,3-diamine
CID 161099965
2-phenyl-4-(9-phenylcarbazol-2-yl)-N-(4-phenylphenyl)aniline
CID 118907856
1-N-phenyl-4-N-[4-(9-phenylcarbazol-3-yl)phenyl]-2-(4-phenylphenyl)benzene-1,4-diamine
CID 175396320
5-carbazol-9-yl-2-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)aniline
CID 163631547
N-(3,5-diphenylphenyl)-2-phenyl-4-[9-(4-phenylphenyl)carbazol-2-yl]aniline
CID 163918921
N-[4-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]-4-phenylaniline
CID 134380568
3-chloro-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 177084601
N-phenyl-9-(4-phenylphenyl)carbazol-2-amine;9-phenyl-N-(4-phenylphenyl)carbazol-3-amine;9-phenyl-N-[9-(4-phenylphenyl)carbazol-2-yl]carbazol-2-amine
CID 159366258
2-[2-(4-methylphenyl)phenyl]-9-[4-(3-phenylphenyl)phenyl]carbazole
CID 118337077
12,26-bis(4-methylphenyl)-2,16-diphenyl-12,26-diazaheptacyclo[15.11.0.03,15.05,13.06,11.019,27.020,25]octacosa-1,3(15),4,6,8,10,13,16,18,20,22,24,27-tridecaene
CID 123155033
2-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 121360373

Frequently Asked Questions

What is the IUPAC name of 9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine?
The IUPAC name of 9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine (CID 129125677) is 9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine.
What is the SMILES notation for 9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine?
The canonical SMILES for 9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine is Cc1ccc(-n2c3ccccc3c3cc(-c4ccccc4)c(Nc4ccccc4)cc32)cc1.
What is the InChIKey of 9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine?
The InChIKey is XZMSFWBYRHNNLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24N2/c1-22-16-18-25(19-17-22)33-30-15-9-8-14-26(30)28-20-27(23-10-4-2-5-11-23)29(21-31(28)33)32-24-12-6-3-7-13-24/h2-21,32H,1H3.
What are the key properties of 9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine?
9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine has a molecular weight of 424.55 g/mol, XLogP of 8.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-methylphenyl)-N,3-diphenylcarbazol-2-amine is sourced from PubChem (CID 129125677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).