9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole

C34H22N2 — CID 154791880

IUPAC9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole
SMILESc1ccc2c(-n3c4ccccc4c4ccccc43)ccc(-n3c4ccccc4c4ccccc43)c2c1
InChIInChI=1S/C34H22N2/c1-2-12-28-27(11-1)33(35-29-17-7-3-13-23(29)24-14-4-8-18-30(24)35)21-22-34(28)36-31-19-9-5-15-25(31)26-16-6-10-20-32(26)36/h1-22H
InChIKeyUYUWGIIRKBLBKJ-UHFFFAOYSA-N
MW458.56 g/mol
LogP9.03
Rot. Bonds2

About 9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole

9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole (PubChem CID 154791880) has the molecular formula C34H22N2 and a molecular weight of 458.56 g/mol. Its IUPAC name is 9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole.

Molecular Properties

Compound Name9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole
PubChem CID154791880
Molecular FormulaC34H22N2
Molecular Weight458.56 g/mol
Exact Mass458.18
IUPAC Name9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole
SMILESc1ccc2c(-n3c4ccccc4c4ccccc43)ccc(-n3c4ccccc4c4ccccc43)c2c1
InChIInChI=1S/C34H22N2/c1-2-12-28-27(11-1)33(35-29-17-7-3-13-23(29)24-14-4-8-18-30(24)35)21-22-34(28)36-31-19-9-5-15-25(31)26-16-6-10-20-32(26)36/h1-22H
InChIKeyUYUWGIIRKBLBKJ-UHFFFAOYSA-N
XLogP9.03
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms36
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500458.56
LogP ≤ 59.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole?
The IUPAC name of 9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole (CID 154791880) is 9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole.
What is the SMILES notation for 9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole?
The canonical SMILES for 9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole is c1ccc2c(-n3c4ccccc4c4ccccc43)ccc(-n3c4ccccc4c4ccccc43)c2c1.
What is the InChIKey of 9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole?
The InChIKey is UYUWGIIRKBLBKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H22N2/c1-2-12-28-27(11-1)33(35-29-17-7-3-13-23(29)24-14-4-8-18-30(24)35)21-22-34(28)36-31-19-9-5-15-25(31)26-16-6-10-20-32(26)36/h1-22H.
What are the key properties of 9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole?
9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole has a molecular weight of 458.56 g/mol, XLogP of 9.03, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole is sourced from PubChem (CID 154791880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).