N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline

C42H30N2 — CID 121312804

IUPACN,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline
SMILESc1ccc(-c2ccc3c4ccccc4n(-c4cccc(-c5cccc(N(c6ccccc6)c6ccccc6)c5)c4)c3c2)cc1
InChIInChI=1S/C42H30N2/c1-4-14-31(15-5-1)34-26-27-40-39-24-10-11-25-41(39)44(42(40)30-34)38-23-13-17-33(29-38)32-16-12-22-37(28-32)43(35-18-6-2-7-19-35)36-20-8-3-9-21-36/h1-30H
InChIKeyXVMQNFMKIXSGKP-UHFFFAOYSA-N
MW562.72 g/mol
LogP11.59
Rot. Bonds6

About N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline

N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline (PubChem CID 121312804) has the molecular formula C42H30N2 and a molecular weight of 562.72 g/mol. Its IUPAC name is N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline.

Molecular Properties

Compound NameN,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline
PubChem CID121312804
Molecular FormulaC42H30N2
Molecular Weight562.72 g/mol
Exact Mass562.24
IUPAC NameN,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline
SMILESc1ccc(-c2ccc3c4ccccc4n(-c4cccc(-c5cccc(N(c6ccccc6)c6ccccc6)c5)c4)c3c2)cc1
InChIInChI=1S/C42H30N2/c1-4-14-31(15-5-1)34-26-27-40-39-24-10-11-25-41(39)44(42(40)30-34)38-23-13-17-33(29-38)32-16-12-22-37(28-32)43(35-18-6-2-7-19-35)36-20-8-3-9-21-36/h1-30H
InChIKeyXVMQNFMKIXSGKP-UHFFFAOYSA-N
XLogP11.59
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500562.72
LogP ≤ 511.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-carbazol-9-ylphenyl)-N,N-bis(4-phenylphenyl)aniline;4-(4-carbazol-9-ylphenyl)-N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenylaniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-3-phenyl-N-(3-phenylphenyl)aniline
CID 161304112
3-(3-carbazol-9-ylphenyl)-N,N-bis(4-phenylphenyl)aniline;3-(4-carbazol-9-ylphenyl)-N,N-bis(4-phenylphenyl)aniline;3-(3-carbazol-9-ylphenyl)-N-phenyl-N-(4-phenylphenyl)aniline;N-[4-(3-carbazol-9-ylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 158440650
N-[3-(4-carbazol-9-ylphenyl)phenyl]-N,9-diphenylcarbazol-2-amine;N-[3-(4-carbazol-9-ylphenyl)phenyl]-N-phenyl-9-(4-phenylphenyl)carbazol-2-amine;N-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-N-phenyl-9-(4-phenylphenyl)carbazol-2-amine;N,N-diphenyl-9-[3-[3-[2-(N-phenylanilino)carbazol-9-yl]phenyl]phenyl]carbazol-2-amine
CID 158451269
2-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazole;N-phenyl-3-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]aniline;9-(3-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;9-(3-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 159658114
N,N-diphenyl-3-[4-phenyl-2-(9-phenylcarbazol-2-yl)phenyl]aniline
CID 118337481
9-(3-phenylphenyl)-2-[4-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]carbazole
CID 165386024
3-(3-carbazol-9-ylphenyl)-N,N-bis(4-phenylphenyl)aniline;3-(3-carbazol-9-ylphenyl)-N,N-diphenylaniline;N-[3-(3-carbazol-9-ylphenyl)phenyl]-N-(3,5-diphenylphenyl)-3,5-diphenylaniline;3-(3-carbazol-9-ylphenyl)-N-phenyl-N-(4-phenylphenyl)aniline;N-[3-(3-carbazol-9-ylphenyl)phenyl]-3-phenyl-N-(3-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-3-(4-phenylphenyl)-N-[3-(4-phenylphenyl)phenyl]aniline
CID 159462354
N,3-diphenyl-N-[4-[5-[9-(3-phenylphenyl)carbazol-2-yl]-1,3,4-thiadiazol-2-yl]phenyl]aniline
CID 122593926
3-[4,6-bis[3-(N-[4-(9-phenylcarbazol-2-yl)phenyl]anilino)phenyl]-1,3,5-triazin-2-yl]-N-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]aniline
CID 126631662
N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]aniline
CID 71038437
N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]carbazol-2-amine
CID 164988539
4-(3-carbazol-9-ylphenyl)-N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline;9-[3-[3-(3-carbazol-9-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]carbazole
CID 161275498

Frequently Asked Questions

What is the IUPAC name of N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline?
The IUPAC name of N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline (CID 121312804) is N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline.
What is the SMILES notation for N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline?
The canonical SMILES for N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline is c1ccc(-c2ccc3c4ccccc4n(-c4cccc(-c5cccc(N(c6ccccc6)c6ccccc6)c5)c4)c3c2)cc1.
What is the InChIKey of N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline?
The InChIKey is XVMQNFMKIXSGKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H30N2/c1-4-14-31(15-5-1)34-26-27-40-39-24-10-11-25-41(39)44(42(40)30-34)38-23-13-17-33(29-38)32-16-12-22-37(28-32)43(35-18-6-2-7-19-35)36-20-8-3-9-21-36/h1-30H.
What are the key properties of N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline?
N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline has a molecular weight of 562.72 g/mol, XLogP of 11.59, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diphenyl-3-[3-(2-phenylcarbazol-9-yl)phenyl]aniline is sourced from PubChem (CID 121312804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).