1-(6-phenyl-2-pyridinyl)-9H-carbazole

C23H16N2 — CID 171438775

IUPAC1-(6-phenyl-2-pyridinyl)-9H-carbazole
SMILESc1ccc(-c2cccc(-c3cccc4c3[nH]c3ccccc34)n2)cc1
InChIInChI=1S/C23H16N2/c1-2-8-16(9-3-1)20-14-7-15-22(24-20)19-12-6-11-18-17-10-4-5-13-21(17)25-23(18)19/h1-15,25H
InChIKeyMJSUGGVQQDKXJU-UHFFFAOYSA-N
MW320.40 g/mol
LogP6.05
Rot. Bonds2

About 1-(6-phenyl-2-pyridinyl)-9H-carbazole

1-(6-phenyl-2-pyridinyl)-9H-carbazole (PubChem CID 171438775) has the molecular formula C23H16N2 and a molecular weight of 320.40 g/mol. Its IUPAC name is 1-(6-phenyl-2-pyridinyl)-9H-carbazole.

Molecular Properties

Compound Name1-(6-phenyl-2-pyridinyl)-9H-carbazole
PubChem CID171438775
Molecular FormulaC23H16N2
Molecular Weight320.40 g/mol
Exact Mass320.13
IUPAC Name1-(6-phenyl-2-pyridinyl)-9H-carbazole
SMILESc1ccc(-c2cccc(-c3cccc4c3[nH]c3ccccc34)n2)cc1
InChIInChI=1S/C23H16N2/c1-2-8-16(9-3-1)20-14-7-15-22(24-20)19-12-6-11-18-17-10-4-5-13-21(17)25-23(18)19/h1-15,25H
InChIKeyMJSUGGVQQDKXJU-UHFFFAOYSA-N
XLogP6.05
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.40
LogP ≤ 56.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(6-phenyl-2-pyridinyl)-9H-carbazole?
The IUPAC name of 1-(6-phenyl-2-pyridinyl)-9H-carbazole (CID 171438775) is 1-(6-phenyl-2-pyridinyl)-9H-carbazole.
What is the SMILES notation for 1-(6-phenyl-2-pyridinyl)-9H-carbazole?
The canonical SMILES for 1-(6-phenyl-2-pyridinyl)-9H-carbazole is c1ccc(-c2cccc(-c3cccc4c3[nH]c3ccccc34)n2)cc1.
What is the InChIKey of 1-(6-phenyl-2-pyridinyl)-9H-carbazole?
The InChIKey is MJSUGGVQQDKXJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2/c1-2-8-16(9-3-1)20-14-7-15-22(24-20)19-12-6-11-18-17-10-4-5-13-21(17)25-23(18)19/h1-15,25H.
What are the key properties of 1-(6-phenyl-2-pyridinyl)-9H-carbazole?
1-(6-phenyl-2-pyridinyl)-9H-carbazole has a molecular weight of 320.40 g/mol, XLogP of 6.05, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-phenyl-2-pyridinyl)-9H-carbazole is sourced from PubChem (CID 171438775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).