3-(1-phenylindol-2-yl)-9H-carbazole

C26H18N2 — CID 142748712

IUPAC3-(1-phenylindol-2-yl)-9H-carbazole
SMILESc1ccc(-n2c(-c3ccc4[nH]c5ccccc5c4c3)cc3ccccc32)cc1
InChIInChI=1S/C26H18N2/c1-2-9-20(10-3-1)28-25-13-7-4-8-18(25)17-26(28)19-14-15-24-22(16-19)21-11-5-6-12-23(21)27-24/h1-17,27H
InChIKeyIRFMRQIUCMTOHI-UHFFFAOYSA-N
MW358.44 g/mol
LogP6.93
Rot. Bonds2

About 3-(1-phenylindol-2-yl)-9H-carbazole

3-(1-phenylindol-2-yl)-9H-carbazole (PubChem CID 142748712) has the molecular formula C26H18N2 and a molecular weight of 358.44 g/mol. Its IUPAC name is 3-(1-phenylindol-2-yl)-9H-carbazole.

Molecular Properties

Compound Name3-(1-phenylindol-2-yl)-9H-carbazole
PubChem CID142748712
Molecular FormulaC26H18N2
Molecular Weight358.44 g/mol
Exact Mass358.15
IUPAC Name3-(1-phenylindol-2-yl)-9H-carbazole
SMILESc1ccc(-n2c(-c3ccc4[nH]c5ccccc5c4c3)cc3ccccc32)cc1
InChIInChI=1S/C26H18N2/c1-2-9-20(10-3-1)28-25-13-7-4-8-18(25)17-26(28)19-14-15-24-22(16-19)21-11-5-6-12-23(21)27-24/h1-17,27H
InChIKeyIRFMRQIUCMTOHI-UHFFFAOYSA-N
XLogP6.93
TPSA20.72 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.44
LogP ≤ 56.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(1-phenylindol-2-yl)-9H-carbazole?
The IUPAC name of 3-(1-phenylindol-2-yl)-9H-carbazole (CID 142748712) is 3-(1-phenylindol-2-yl)-9H-carbazole.
What is the SMILES notation for 3-(1-phenylindol-2-yl)-9H-carbazole?
The canonical SMILES for 3-(1-phenylindol-2-yl)-9H-carbazole is c1ccc(-n2c(-c3ccc4[nH]c5ccccc5c4c3)cc3ccccc32)cc1.
What is the InChIKey of 3-(1-phenylindol-2-yl)-9H-carbazole?
The InChIKey is IRFMRQIUCMTOHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N2/c1-2-9-20(10-3-1)28-25-13-7-4-8-18(25)17-26(28)19-14-15-24-22(16-19)21-11-5-6-12-23(21)27-24/h1-17,27H.
What are the key properties of 3-(1-phenylindol-2-yl)-9H-carbazole?
3-(1-phenylindol-2-yl)-9H-carbazole has a molecular weight of 358.44 g/mol, XLogP of 6.93, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-phenylindol-2-yl)-9H-carbazole is sourced from PubChem (CID 142748712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).