9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole

C34H24N2 — CID 91073936

IUPAC9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole
SMILESC1=C(n2cccc2)C(C2C(n3c4ccccc4c4ccccc43)=Cc3ccccc32)c2ccccc21
InChIInChI=1S/C34H24N2/c1-3-13-25-23(11-1)21-31(35-19-9-10-20-35)33(25)34-26-14-4-2-12-24(26)22-32(34)36-29-17-7-5-15-27(29)28-16-6-8-18-30(28)36/h1-22,33-34H
InChIKeyGYKPDESIIRASMF-UHFFFAOYSA-N
MW460.58 g/mol
LogP8.49
Rot. Bonds3

About 9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole

9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole (PubChem CID 91073936) has the molecular formula C34H24N2 and a molecular weight of 460.58 g/mol. Its IUPAC name is 9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole.

Molecular Properties

Compound Name9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole
PubChem CID91073936
Molecular FormulaC34H24N2
Molecular Weight460.58 g/mol
Exact Mass460.19
IUPAC Name9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole
SMILESC1=C(n2cccc2)C(C2C(n3c4ccccc4c4ccccc43)=Cc3ccccc32)c2ccccc21
InChIInChI=1S/C34H24N2/c1-3-13-25-23(11-1)21-31(35-19-9-10-20-35)33(25)34-26-14-4-2-12-24(26)22-32(34)36-29-17-7-5-15-27(29)28-16-6-8-18-30(28)36/h1-22,33-34H
InChIKeyGYKPDESIIRASMF-UHFFFAOYSA-N
XLogP8.49
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500460.58
LogP ≤ 58.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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9-[3,5-di(carbazol-9-yl)-6-methylcyclohexa-1,3-dien-1-yl]carbazole
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9-[9-[4-[4-(2-carbazol-9-yl-9H-fluoren-9-yl)phenyl]phenyl]-9H-fluoren-2-yl]carbazole
CID 134379825
2-carbazol-9-ylbenzene-1,3-diamine
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Frequently Asked Questions

What is the IUPAC name of 9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole?
The IUPAC name of 9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole (CID 91073936) is 9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole.
What is the SMILES notation for 9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole?
The canonical SMILES for 9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole is C1=C(n2cccc2)C(C2C(n3c4ccccc4c4ccccc43)=Cc3ccccc32)c2ccccc21.
What is the InChIKey of 9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole?
The InChIKey is GYKPDESIIRASMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H24N2/c1-3-13-25-23(11-1)21-31(35-19-9-10-20-35)33(25)34-26-14-4-2-12-24(26)22-32(34)36-29-17-7-5-15-27(29)28-16-6-8-18-30(28)36/h1-22,33-34H.
What are the key properties of 9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole?
9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole has a molecular weight of 460.58 g/mol, XLogP of 8.49, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[1-(2-pyrrol-1-yl-1H-inden-1-yl)-1H-inden-2-yl]carbazole is sourced from PubChem (CID 91073936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).