2-bromo-9-naphthalen-2-ylcarbazole

C22H14BrN — CID 71302478

IUPAC2-bromo-9-naphthalen-2-ylcarbazole
SMILESBrc1ccc2c3ccccc3n(-c3ccc4ccccc4c3)c2c1
InChIInChI=1S/C22H14BrN/c23-17-10-12-20-19-7-3-4-8-21(19)24(22(20)14-17)18-11-9-15-5-1-2-6-16(15)13-18/h1-14H
InChIKeyPYHCFFLUGHKAPZ-UHFFFAOYSA-N
MW372.27 g/mol
LogP6.70
Rot. Bonds1

About 2-bromo-9-naphthalen-2-ylcarbazole

2-bromo-9-naphthalen-2-ylcarbazole (PubChem CID 71302478) has the molecular formula C22H14BrN and a molecular weight of 372.27 g/mol. Its IUPAC name is 2-bromo-9-naphthalen-2-ylcarbazole.

Molecular Properties

Compound Name2-bromo-9-naphthalen-2-ylcarbazole
PubChem CID71302478
Molecular FormulaC22H14BrN
Molecular Weight372.27 g/mol
Exact Mass371.03
IUPAC Name2-bromo-9-naphthalen-2-ylcarbazole
SMILESBrc1ccc2c3ccccc3n(-c3ccc4ccccc4c3)c2c1
InChIInChI=1S/C22H14BrN/c23-17-10-12-20-19-7-3-4-8-21(19)24(22(20)14-17)18-11-9-15-5-1-2-6-16(15)13-18/h1-14H
InChIKeyPYHCFFLUGHKAPZ-UHFFFAOYSA-N
XLogP6.70
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.27
LogP ≤ 56.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-9-naphthalen-2-ylcarbazole?
The IUPAC name of 2-bromo-9-naphthalen-2-ylcarbazole (CID 71302478) is 2-bromo-9-naphthalen-2-ylcarbazole.
What is the SMILES notation for 2-bromo-9-naphthalen-2-ylcarbazole?
The canonical SMILES for 2-bromo-9-naphthalen-2-ylcarbazole is Brc1ccc2c3ccccc3n(-c3ccc4ccccc4c3)c2c1.
What is the InChIKey of 2-bromo-9-naphthalen-2-ylcarbazole?
The InChIKey is PYHCFFLUGHKAPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14BrN/c23-17-10-12-20-19-7-3-4-8-21(19)24(22(20)14-17)18-11-9-15-5-1-2-6-16(15)13-18/h1-14H.
What are the key properties of 2-bromo-9-naphthalen-2-ylcarbazole?
2-bromo-9-naphthalen-2-ylcarbazole has a molecular weight of 372.27 g/mol, XLogP of 6.70, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-9-naphthalen-2-ylcarbazole is sourced from PubChem (CID 71302478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).