N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine

C60H44N2 — CID 177128376

IUPACN-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine
SMILESCc1cc(C)c2c3ccc(N(c4ccc(-c5ccc(-c6ccccc6)cc5-c5ccccc5)cc4)c4ccc5ccccc5c4-c4ccccc4)cc3n(-c3ccccc3)c2c1
InChIInChI=1S/C60H44N2/c1-41-37-42(2)59-54-35-33-51(40-57(54)62(58(59)38-41)49-24-13-6-14-25-49)61(56-36-30-45-21-15-16-26-53(45)60(56)47-22-11-5-12-23-47)50-31-27-46(28-32-50)52-34-29-48(43-17-7-3-8-18-43)39-55(52)44-19-9-4-10-20-44/h3-40H,1-2H3
InChIKeyKRCXYNVZJAPWBC-UHFFFAOYSA-N
MW793.03 g/mol
LogP16.69
Rot. Bonds8

About N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine

N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine (PubChem CID 177128376) has the molecular formula C60H44N2 and a molecular weight of 793.03 g/mol. Its IUPAC name is N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine.

Molecular Properties

Compound NameN-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine
PubChem CID177128376
Molecular FormulaC60H44N2
Molecular Weight793.03 g/mol
Exact Mass792.35
IUPAC NameN-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine
SMILESCc1cc(C)c2c3ccc(N(c4ccc(-c5ccc(-c6ccccc6)cc5-c5ccccc5)cc4)c4ccc5ccccc5c4-c4ccccc4)cc3n(-c3ccccc3)c2c1
InChIInChI=1S/C60H44N2/c1-41-37-42(2)59-54-35-33-51(40-57(54)62(58(59)38-41)49-24-13-6-14-25-49)61(56-36-30-45-21-15-16-26-53(45)60(56)47-22-11-5-12-23-47)50-31-27-46(28-32-50)52-34-29-48(43-17-7-3-8-18-43)39-55(52)44-19-9-4-10-20-44/h3-40H,1-2H3
InChIKeyKRCXYNVZJAPWBC-UHFFFAOYSA-N
XLogP16.69
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500793.03
LogP ≤ 516.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(2,5-diphenylphenyl)phenyl]-5-methyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine
CID 177128347
N-(3,4-diphenylphenyl)-5-methyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine
CID 177128321
N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine
CID 177128422
N-(4-phenanthren-2-ylphenyl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-2-amine
CID 172501369
N-[4-(4-naphthalen-2-ylphenyl)phenyl]-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-2-amine
CID 172501973
N-[4-(3,4-diphenylphenyl)phenyl]-N-(1-phenylnaphthalen-2-yl)dibenzofuran-3-amine
CID 177128275
N-(2,3-diphenylphenyl)-9-phenyl-N-(6-phenylnaphthalen-2-yl)carbazol-2-amine
CID 165394959
N-(4-naphthalen-2-ylphenyl)-9-phenyl-5-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
CID 169010246
N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 169009927
N-(3-naphthalen-1-yl-2-naphthalen-2-ylphenyl)-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 177097182
N-[4-(3,4-diphenylphenyl)phenyl]-N-[3-(9-phenylcarbazol-4-yl)phenyl]naphthalen-1-amine
CID 164832079
N-[4-(4-naphthalen-2-ylphenyl)phenyl]-3-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-2-(2-phenylphenyl)aniline
CID 168790792

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine?
The IUPAC name of N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine (CID 177128376) is N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine.
What is the SMILES notation for N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine?
The canonical SMILES for N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine is Cc1cc(C)c2c3ccc(N(c4ccc(-c5ccc(-c6ccccc6)cc5-c5ccccc5)cc4)c4ccc5ccccc5c4-c4ccccc4)cc3n(-c3ccccc3)c2c1.
What is the InChIKey of N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine?
The InChIKey is KRCXYNVZJAPWBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H44N2/c1-41-37-42(2)59-54-35-33-51(40-57(54)62(58(59)38-41)49-24-13-6-14-25-49)61(56-36-30-45-21-15-16-26-53(45)60(56)47-22-11-5-12-23-47)50-31-27-46(28-32-50)52-34-29-48(43-17-7-3-8-18-43)39-55(52)44-19-9-4-10-20-44/h3-40H,1-2H3.
What are the key properties of N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine?
N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine has a molecular weight of 793.03 g/mol, XLogP of 16.69, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine is sourced from PubChem (CID 177128376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).