9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine

C43H32N2O — CID 90377538

IUPAC9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine
SMILESCOc1ccc(-n2c3ccccc3c3c(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cccc32)cc1
InChIInChI=1S/C43H32N2O/c1-46-38-29-27-37(28-30-38)45-40-16-9-8-15-39(40)43-41(17-10-18-42(43)45)44(35-23-19-33(20-24-35)31-11-4-2-5-12-31)36-25-21-34(22-26-36)32-13-6-3-7-14-32/h2-30H,1H3
InChIKeyMDTGNXORSNROHP-UHFFFAOYSA-N
MW592.74 g/mol
LogP11.60
Rot. Bonds7

About 9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine

9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine (PubChem CID 90377538) has the molecular formula C43H32N2O and a molecular weight of 592.74 g/mol. Its IUPAC name is 9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine.

Molecular Properties

Compound Name9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine
PubChem CID90377538
Molecular FormulaC43H32N2O
Molecular Weight592.74 g/mol
Exact Mass592.25
IUPAC Name9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine
SMILESCOc1ccc(-n2c3ccccc3c3c(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cccc32)cc1
InChIInChI=1S/C43H32N2O/c1-46-38-29-27-37(28-30-38)45-40-16-9-8-15-39(40)43-41(17-10-18-42(43)45)44(35-23-19-33(20-24-35)31-11-4-2-5-12-31)36-25-21-34(22-26-36)32-13-6-3-7-14-32/h2-30H,1H3
InChIKeyMDTGNXORSNROHP-UHFFFAOYSA-N
XLogP11.60
TPSA17.40 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500592.74
LogP ≤ 511.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine
CID 90377540
1-N,5-N-bis(4-methoxyphenyl)-1-N,5-N-bis(4-phenylphenyl)naphthalene-1,5-diamine
CID 101381671
N,9-diphenyl-N-[6-(6-phenylnaphthalen-2-yl)naphthalen-2-yl]carbazol-4-amine
CID 174257716
N,N,9-tris(4-phenylphenyl)carbazol-2-amine;N,N,9-tris(4-phenylphenyl)carbazol-3-amine;N,N,9-tris(4-phenylphenyl)carbazol-4-amine
CID 159285167
2-N,4-N,4-N-triphenyl-2-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole-2,4-diamine
CID 154965850
N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine
CID 174258250
[4-(4-phenyl-N-(9-phenylcarbazol-4-yl)anilino)phenyl]boronic acid
CID 171410503
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline
CID 160761682
N-(4-methoxyphenyl)-N-[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]-9-phenylcarbazol-3-amine
CID 58651978
9-[4-(4-methoxyphenyl)phenyl]carbazole
CID 58905910
9-phenyl-N-(4-phenylphenyl)-N-[4-[3-phenyl-5-(9-phenylcarbazol-4-yl)phenyl]phenyl]carbazol-4-amine
CID 176878123
N-phenyl-N-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazol-1-amine
CID 155004275

Frequently Asked Questions

What is the IUPAC name of 9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine?
The IUPAC name of 9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine (CID 90377538) is 9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine.
What is the SMILES notation for 9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine?
The canonical SMILES for 9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine is COc1ccc(-n2c3ccccc3c3c(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cccc32)cc1.
What is the InChIKey of 9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine?
The InChIKey is MDTGNXORSNROHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H32N2O/c1-46-38-29-27-37(28-30-38)45-40-16-9-8-15-39(40)43-41(17-10-18-42(43)45)44(35-23-19-33(20-24-35)31-11-4-2-5-12-31)36-25-21-34(22-26-36)32-13-6-3-7-14-32/h2-30H,1H3.
What are the key properties of 9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine?
9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine has a molecular weight of 592.74 g/mol, XLogP of 11.60, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-methoxyphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine is sourced from PubChem (CID 90377538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).