7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine

C38H29N3 — CID 152929920

IUPAC7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine
SMILESC=Cc1ccc(N(c2ccccc2)c2ccc3c4ccc(Nc5ccccc5)cc4n(-c4ccccc4)c3c2)cc1
InChIInChI=1S/C38H29N3/c1-2-28-18-21-33(22-19-28)40(31-14-8-4-9-15-31)34-23-25-36-35-24-20-30(39-29-12-6-3-7-13-29)26-37(35)41(38(36)27-34)32-16-10-5-11-17-32/h2-27,39H,1H2
InChIKeyUKTKMASBRHAHTB-UHFFFAOYSA-N
MW527.67 g/mol
LogP10.64
Rot. Bonds7

About 7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine

7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine (PubChem CID 152929920) has the molecular formula C38H29N3 and a molecular weight of 527.67 g/mol. Its IUPAC name is 7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine.

Molecular Properties

Compound Name7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine
PubChem CID152929920
Molecular FormulaC38H29N3
Molecular Weight527.67 g/mol
Exact Mass527.24
IUPAC Name7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine
SMILESC=Cc1ccc(N(c2ccccc2)c2ccc3c4ccc(Nc5ccccc5)cc4n(-c4ccccc4)c3c2)cc1
InChIInChI=1S/C38H29N3/c1-2-28-18-21-33(22-19-28)40(31-14-8-4-9-15-31)34-23-25-36-35-24-20-30(39-29-12-6-3-7-13-29)26-37(35)41(38(36)27-34)32-16-10-5-11-17-32/h2-27,39H,1H2
InChIKeyUKTKMASBRHAHTB-UHFFFAOYSA-N
XLogP10.64
TPSA20.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500527.67
LogP ≤ 510.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(4-ethenylphenyl)phenyl]-9-phenylcarbazol-2-amine
CID 166647227
6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenylcarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine
CID 139320793
4-[6-(4-ethenylphenyl)-9-phenylcarbazol-3-yl]-N-phenylaniline
CID 155015689
6,9-bis(4-ethenylphenyl)-N-phenylcarbazol-3-amine
CID 166764079
4-N-[4-[9-(4-ethenylphenyl)carbazol-3-yl]phenyl]-4-N-[4-[4-[4-[9-(4-ethenylphenyl)carbazol-3-yl]-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine
CID 137428819
4-[(Z)-2-(4-carbazol-9-ylphenyl)-2-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]ethenyl]-N-phenylaniline
CID 121256430
6-ethenyl-N-(4-methylphenyl)-N,9-diphenylcarbazol-3-amine
CID 166764286
4-[4-(4-ethenylphenyl)phenyl]-N,N-bis[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 58568926
4-(4-ethenylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 177116992
N-[4-(4-anilinophenyl)phenyl]-9-(4-fluorophenyl)-N-phenylcarbazol-3-amine
CID 138528996
4-ethenyl-N-phenylaniline
CID 21478062
N-[4-[9-(4-ethenylphenyl)-6-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 142340184

Frequently Asked Questions

What is the IUPAC name of 7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine?
The IUPAC name of 7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine (CID 152929920) is 7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine.
What is the SMILES notation for 7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine?
The canonical SMILES for 7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine is C=Cc1ccc(N(c2ccccc2)c2ccc3c4ccc(Nc5ccccc5)cc4n(-c4ccccc4)c3c2)cc1.
What is the InChIKey of 7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine?
The InChIKey is UKTKMASBRHAHTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H29N3/c1-2-28-18-21-33(22-19-28)40(31-14-8-4-9-15-31)34-23-25-36-35-24-20-30(39-29-12-6-3-7-13-29)26-37(35)41(38(36)27-34)32-16-10-5-11-17-32/h2-27,39H,1H2.
What are the key properties of 7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine?
7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine has a molecular weight of 527.67 g/mol, XLogP of 10.64, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-N-(4-ethenylphenyl)-2-N,7-N,9-triphenylcarbazole-2,7-diamine is sourced from PubChem (CID 152929920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).