9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole

C30H21N3 — CID 170396111

IUPAC9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole
SMILESCc1ccc(-n2c3ccccc3c3ccccc32)nc1-n1c2ccccc2c2ccccc21
InChIInChI=1S/C30H21N3/c1-20-18-19-29(32-25-14-6-2-10-21(25)22-11-3-7-15-26(22)32)31-30(20)33-27-16-8-4-12-23(27)24-13-5-9-17-28(24)33/h2-19H,1H3
InChIKeyFFURUUCIMFWAMD-UHFFFAOYSA-N
MW423.52 g/mol
LogP7.58
Rot. Bonds2

About 9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole

9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole (PubChem CID 170396111) has the molecular formula C30H21N3 and a molecular weight of 423.52 g/mol. Its IUPAC name is 9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole.

Molecular Properties

Compound Name9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole
PubChem CID170396111
Molecular FormulaC30H21N3
Molecular Weight423.52 g/mol
Exact Mass423.17
IUPAC Name9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole
SMILESCc1ccc(-n2c3ccccc3c3ccccc32)nc1-n1c2ccccc2c2ccccc21
InChIInChI=1S/C30H21N3/c1-20-18-19-29(32-25-14-6-2-10-21(25)22-11-3-7-15-26(22)32)31-30(20)33-27-16-8-4-12-23(27)24-13-5-9-17-28(24)33/h2-19H,1H3
InChIKeyFFURUUCIMFWAMD-UHFFFAOYSA-N
XLogP7.58
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms33
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.52
LogP ≤ 57.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole?
The IUPAC name of 9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole (CID 170396111) is 9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole.
What is the SMILES notation for 9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole?
The canonical SMILES for 9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole is Cc1ccc(-n2c3ccccc3c3ccccc32)nc1-n1c2ccccc2c2ccccc21.
What is the InChIKey of 9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole?
The InChIKey is FFURUUCIMFWAMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H21N3/c1-20-18-19-29(32-25-14-6-2-10-21(25)22-11-3-7-15-26(22)32)31-30(20)33-27-16-8-4-12-23(27)24-13-5-9-17-28(24)33/h2-19H,1H3.
What are the key properties of 9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole?
9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole has a molecular weight of 423.52 g/mol, XLogP of 7.58, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(6-carbazol-9-yl-3-methyl-2-pyridinyl)carbazole is sourced from PubChem (CID 170396111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).