7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine

C50H34N2 — CID 146573851

IUPAC7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine
SMILESc1ccc(N(c2ccc(-c3ccc4ccccc4c3)cc2)c2ccc3c4ccc(-c5cccc6ccccc56)cc4n(-c4ccccc4)c3c2)cc1
InChIInChI=1S/C50H34N2/c1-3-16-41(17-4-1)51(43-27-24-36(25-28-43)39-23-22-35-12-7-8-14-38(35)32-39)44-29-31-48-47-30-26-40(46-21-11-15-37-13-9-10-20-45(37)46)33-49(47)52(50(48)34-44)42-18-5-2-6-19-42/h1-34H
InChIKeyJWARHONZBBJPQY-UHFFFAOYSA-N
MW662.84 g/mol
LogP13.89
Rot. Bonds6

About 7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine

7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine (PubChem CID 146573851) has the molecular formula C50H34N2 and a molecular weight of 662.84 g/mol. Its IUPAC name is 7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine.

Molecular Properties

Compound Name7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine
PubChem CID146573851
Molecular FormulaC50H34N2
Molecular Weight662.84 g/mol
Exact Mass662.27
IUPAC Name7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine
SMILESc1ccc(N(c2ccc(-c3ccc4ccccc4c3)cc2)c2ccc3c4ccc(-c5cccc6ccccc56)cc4n(-c4ccccc4)c3c2)cc1
InChIInChI=1S/C50H34N2/c1-3-16-41(17-4-1)51(43-27-24-36(25-28-43)39-23-22-35-12-7-8-14-38(35)32-39)44-29-31-48-47-30-26-40(46-21-11-15-37-13-9-10-20-45(37)46)33-49(47)52(50(48)34-44)42-18-5-2-6-19-42/h1-34H
InChIKeyJWARHONZBBJPQY-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

7-naphthalen-2-yl-N,N,9-triphenylcarbazol-2-amine
CID 146573850
3-(7,9-diphenylcarbazol-4-yl)-N-(4-naphthalen-1-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 166659601
N-(4-naphthalen-1-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-3-(2,7,9-triphenylcarbazol-4-yl)aniline
CID 166659667
N-[4-(7-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(3-phenylphenyl)carbazol-2-amine
CID 174258406
3-[4-naphthalen-2-yl-2-(9-phenylcarbazol-2-yl)phenyl]-N,N-bis(4-phenylphenyl)aniline
CID 126628031
5-naphthalen-2-yl-9-phenyl-N-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
CID 169010271
5-naphthalen-2-yl-N,9-diphenyl-N-(3-phenylphenyl)carbazol-2-amine
CID 169009775
5-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 169010262
N-(4-carbazol-9-ylphenyl)-4-naphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-naphthalen-2-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-phenylaniline
CID 157492697
N-[3-(7-naphthalen-2-ylnaphthalen-2-yl)phenyl]-N,9-diphenylcarbazol-2-amine
CID 174258383
N,7-diphenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-N,7-diphenyl-9-(3-phenylphenyl)carbazol-2-amine;7-phenyl-9-(3-phenylphenyl)-N,N-bis(4-phenylphenyl)carbazol-2-amine;N,N,7-triphenyl-9-(2-phenylphenyl)carbazol-2-amine;N,N,7-triphenyl-9-(3-phenylphenyl)carbazol-2-amine
CID 160535773
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenanthren-2-ylphenyl)-3-(5-phenylbenzo[b]carbazol-1-yl)aniline
CID 166660110

Frequently Asked Questions

What is the IUPAC name of 7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine?
The IUPAC name of 7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine (CID 146573851) is 7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine.
What is the SMILES notation for 7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine?
The canonical SMILES for 7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine is c1ccc(N(c2ccc(-c3ccc4ccccc4c3)cc2)c2ccc3c4ccc(-c5cccc6ccccc56)cc4n(-c4ccccc4)c3c2)cc1.
What is the InChIKey of 7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine?
The InChIKey is JWARHONZBBJPQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H34N2/c1-3-16-41(17-4-1)51(43-27-24-36(25-28-43)39-23-22-35-12-7-8-14-38(35)32-39)44-29-31-48-47-30-26-40(46-21-11-15-37-13-9-10-20-45(37)46)33-49(47)52(50(48)34-44)42-18-5-2-6-19-42/h1-34H.
What are the key properties of 7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine?
7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-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 7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine is sourced from PubChem (CID 146573851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).