N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline

C37H28N2 — CID 170227325

IUPACN-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline
SMILESCN(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2-n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C37H28N2/c1-38(30-23-19-28(20-24-30)27-11-3-2-4-12-27)31-25-21-29(22-26-31)32-13-5-8-16-35(32)39-36-17-9-6-14-33(36)34-15-7-10-18-37(34)39/h2-26H,1H3
InChIKeyKAVHFWCXZFXRGJ-UHFFFAOYSA-N
MW500.65 g/mol
LogP9.89
Rot. Bonds5

About N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline

N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline (PubChem CID 170227325) has the molecular formula C37H28N2 and a molecular weight of 500.65 g/mol. Its IUPAC name is N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline.

Molecular Properties

Compound NameN-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline
PubChem CID170227325
Molecular FormulaC37H28N2
Molecular Weight500.65 g/mol
Exact Mass500.23
IUPAC NameN-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline
SMILESCN(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2-n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C37H28N2/c1-38(30-23-19-28(20-24-30)27-11-3-2-4-12-27)31-25-21-29(22-26-31)32-13-5-8-16-35(32)39-36-17-9-6-14-33(36)34-15-7-10-18-37(34)39/h2-26H,1H3
InChIKeyKAVHFWCXZFXRGJ-UHFFFAOYSA-N
XLogP9.89
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500500.65
LogP ≤ 59.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(2-carbazol-9-ylphenyl)phenyl]-4-phenyl-N-[4-(2-phenylphenyl)phenyl]aniline
CID 134380712
N-[4-(2-carbazol-9-ylphenyl)phenyl]-4-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 138467769
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-2-(4-phenylphenyl)aniline
CID 142416169
4-(2-carbazol-9-ylphenyl)-N-phenyl-N-[4-(4-phenylnaphthalen-1-yl)phenyl]aniline
CID 167528490
9,14-bis[2-(4-phenylphenyl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;ethane
CID 177063693
4-phenyl-N-[4-[4-[2-(2-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 155037999
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N,4-diphenylaniline
CID 167322731
N,N-bis[4-(2-carbazol-9-ylphenyl)phenyl]-2-phenylaniline
CID 142416181
N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-4-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 168798366
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-(3,4-diphenylphenyl)phenyl]-4-(4-phenylphenyl)aniline
CID 164832068
N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N,3-diphenylaniline
CID 167322503
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline
CID 162491110

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline?
The IUPAC name of N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline (CID 170227325) is N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline.
What is the SMILES notation for N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline?
The canonical SMILES for N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline is CN(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2-n2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline?
The InChIKey is KAVHFWCXZFXRGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H28N2/c1-38(30-23-19-28(20-24-30)27-11-3-2-4-12-27)31-25-21-29(22-26-31)32-13-5-8-16-35(32)39-36-17-9-6-14-33(36)34-15-7-10-18-37(34)39/h2-26H,1H3.
What are the key properties of N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline?
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline has a molecular weight of 500.65 g/mol, XLogP of 9.89, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-methyl-4-phenylaniline is sourced from PubChem (CID 170227325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).