N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine

C50H34N2 — CID 155034940

IUPACN-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc5ccccc5c4)c4c5ccccc5cc5c4c4ccccc4n5-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C50H34N2/c1-3-13-35(14-4-1)37-23-25-38(26-24-37)39-27-30-43(31-28-39)51(44-32-29-36-15-7-8-16-40(36)33-44)50-45-20-10-9-17-41(45)34-48-49(50)46-21-11-12-22-47(46)52(48)42-18-5-2-6-19-42/h1-34H
InChIKeyRGULHXKMZWMYPQ-UHFFFAOYSA-N
MW662.84 g/mol
LogP13.89
Rot. Bonds6

About N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine

N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine (PubChem CID 155034940) has the molecular formula C50H34N2 and a molecular weight of 662.84 g/mol. Its IUPAC name is N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine.

Molecular Properties

Compound NameN-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine
PubChem CID155034940
Molecular FormulaC50H34N2
Molecular Weight662.84 g/mol
Exact Mass662.27
IUPAC NameN-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc5ccccc5c4)c4c5ccccc5cc5c4c4ccccc4n5-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C50H34N2/c1-3-13-35(14-4-1)37-23-25-38(26-24-37)39-27-30-43(31-28-39)51(44-32-29-36-15-7-8-16-40(36)33-44)50-45-20-10-9-17-41(45)34-48-49(50)46-21-11-12-22-47(46)52(48)42-18-5-2-6-19-42/h1-34H
InChIKeyRGULHXKMZWMYPQ-UHFFFAOYSA-N
XLogP13.89
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500662.84
LogP ≤ 513.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-naphthalen-2-ylphenyl)-6-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 166956432
N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine
CID 165006232
N-[7-(3-naphthalen-2-ylphenyl)naphthalen-2-yl]-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 174258176
N,5-diphenyl-N-(4-phenylphenyl)benzo[b]carbazol-9-amine
CID 166847645
N,9-diphenyl-N-[6-(6-phenylnaphthalen-2-yl)naphthalen-2-yl]carbazol-2-amine
CID 174257903
N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;N-[4-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline;9-phenylcarbazole
CID 158239659
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-naphthalen-2-ylphenyl)-4-(4-phenylphenyl)aniline
CID 146579381
10-[3,5-bis(9-phenylcarbazol-2-yl)phenyl]-N,N-bis(4-phenylphenyl)anthracen-9-amine;10-[3,5-bis(9-phenylcarbazol-2-yl)phenyl]-N-naphthalen-2-yl-N-phenylanthracen-9-amine;10-[3,5-bis(9-phenylcarbazol-2-yl)phenyl]-N-phenyl-N-(4-phenylphenyl)anthracen-9-amine
CID 159134168
N-[4-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 118103057
N-[4-(7-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(3-phenylphenyl)carbazol-2-amine
CID 174258406
N-[4-[2-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 130452731
3-phenyl-N-[3-(5-phenylbenzo[b]carbazol-11-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167195423

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine?
The IUPAC name of N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine (CID 155034940) is N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine.
What is the SMILES notation for N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine?
The canonical SMILES for N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc5ccccc5c4)c4c5ccccc5cc5c4c4ccccc4n5-c4ccccc4)cc3)cc2)cc1.
What is the InChIKey of N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine?
The InChIKey is RGULHXKMZWMYPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H34N2/c1-3-13-35(14-4-1)37-23-25-38(26-24-37)39-27-30-43(31-28-39)51(44-32-29-36-15-7-8-16-40(36)33-44)50-45-20-10-9-17-41(45)34-48-49(50)46-21-11-12-22-47(46)52(48)42-18-5-2-6-19-42/h1-34H.
What are the key properties of N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine?
N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine has a molecular weight of 662.84 g/mol, XLogP of 13.89, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b]carbazol-11-amine is sourced from PubChem (CID 155034940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).