9-(2-pyridin-3-yl-4-pyridinyl)carbazole

C22H15N3 — CID 171768043

IUPAC9-(2-pyridin-3-yl-4-pyridinyl)carbazole
SMILESc1cncc(-c2cc(-n3c4ccccc4c4ccccc43)ccn2)c1
InChIInChI=1S/C22H15N3/c1-3-9-21-18(7-1)19-8-2-4-10-22(19)25(21)17-11-13-24-20(14-17)16-6-5-12-23-15-16/h1-15H
InChIKeyCKLIYUAFJDWKGT-UHFFFAOYSA-N
MW321.38 g/mol
LogP5.24
Rot. Bonds2

About 9-(2-pyridin-3-yl-4-pyridinyl)carbazole

9-(2-pyridin-3-yl-4-pyridinyl)carbazole (PubChem CID 171768043) has the molecular formula C22H15N3 and a molecular weight of 321.38 g/mol. Its IUPAC name is 9-(2-pyridin-3-yl-4-pyridinyl)carbazole.

Molecular Properties

Compound Name9-(2-pyridin-3-yl-4-pyridinyl)carbazole
PubChem CID171768043
Molecular FormulaC22H15N3
Molecular Weight321.38 g/mol
Exact Mass321.13
IUPAC Name9-(2-pyridin-3-yl-4-pyridinyl)carbazole
SMILESc1cncc(-c2cc(-n3c4ccccc4c4ccccc43)ccn2)c1
InChIInChI=1S/C22H15N3/c1-3-9-21-18(7-1)19-8-2-4-10-22(19)25(21)17-11-13-24-20(14-17)16-6-5-12-23-15-16/h1-15H
InChIKeyCKLIYUAFJDWKGT-UHFFFAOYSA-N
XLogP5.24
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.38
LogP ≤ 55.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-(2-pyridin-3-yl-4-pyridinyl)carbazole?
The IUPAC name of 9-(2-pyridin-3-yl-4-pyridinyl)carbazole (CID 171768043) is 9-(2-pyridin-3-yl-4-pyridinyl)carbazole.
What is the SMILES notation for 9-(2-pyridin-3-yl-4-pyridinyl)carbazole?
The canonical SMILES for 9-(2-pyridin-3-yl-4-pyridinyl)carbazole is c1cncc(-c2cc(-n3c4ccccc4c4ccccc43)ccn2)c1.
What is the InChIKey of 9-(2-pyridin-3-yl-4-pyridinyl)carbazole?
The InChIKey is CKLIYUAFJDWKGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N3/c1-3-9-21-18(7-1)19-8-2-4-10-22(19)25(21)17-11-13-24-20(14-17)16-6-5-12-23-15-16/h1-15H.
What are the key properties of 9-(2-pyridin-3-yl-4-pyridinyl)carbazole?
9-(2-pyridin-3-yl-4-pyridinyl)carbazole has a molecular weight of 321.38 g/mol, XLogP of 5.24, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-pyridin-3-yl-4-pyridinyl)carbazole is sourced from PubChem (CID 171768043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).