6-bromo-9-ethyl-1-phenylcarbazole

C20H16BrN — CID 174702524

IUPAC6-bromo-9-ethyl-1-phenylcarbazole
SMILESCCn1c2ccc(Br)cc2c2cccc(-c3ccccc3)c21
InChIInChI=1S/C20H16BrN/c1-2-22-19-12-11-15(21)13-18(19)17-10-6-9-16(20(17)22)14-7-4-3-5-8-14/h3-13H,2H2,1H3
InChIKeyGCYWECVQHVYKLK-UHFFFAOYSA-N
MW350.26 g/mol
LogP6.24
Rot. Bonds2

About 6-bromo-9-ethyl-1-phenylcarbazole

6-bromo-9-ethyl-1-phenylcarbazole (PubChem CID 174702524) has the molecular formula C20H16BrN and a molecular weight of 350.26 g/mol. Its IUPAC name is 6-bromo-9-ethyl-1-phenylcarbazole.

Molecular Properties

Compound Name6-bromo-9-ethyl-1-phenylcarbazole
PubChem CID174702524
Molecular FormulaC20H16BrN
Molecular Weight350.26 g/mol
Exact Mass349.05
IUPAC Name6-bromo-9-ethyl-1-phenylcarbazole
SMILESCCn1c2ccc(Br)cc2c2cccc(-c3ccccc3)c21
InChIInChI=1S/C20H16BrN/c1-2-22-19-12-11-15(21)13-18(19)17-10-6-9-16(20(17)22)14-7-4-3-5-8-14/h3-13H,2H2,1H3
InChIKeyGCYWECVQHVYKLK-UHFFFAOYSA-N
XLogP6.24
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.26
LogP ≤ 56.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-9-ethyl-1-phenylcarbazole?
The IUPAC name of 6-bromo-9-ethyl-1-phenylcarbazole (CID 174702524) is 6-bromo-9-ethyl-1-phenylcarbazole.
What is the SMILES notation for 6-bromo-9-ethyl-1-phenylcarbazole?
The canonical SMILES for 6-bromo-9-ethyl-1-phenylcarbazole is CCn1c2ccc(Br)cc2c2cccc(-c3ccccc3)c21.
What is the InChIKey of 6-bromo-9-ethyl-1-phenylcarbazole?
The InChIKey is GCYWECVQHVYKLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16BrN/c1-2-22-19-12-11-15(21)13-18(19)17-10-6-9-16(20(17)22)14-7-4-3-5-8-14/h3-13H,2H2,1H3.
What are the key properties of 6-bromo-9-ethyl-1-phenylcarbazole?
6-bromo-9-ethyl-1-phenylcarbazole has a molecular weight of 350.26 g/mol, XLogP of 6.24, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-9-ethyl-1-phenylcarbazole is sourced from PubChem (CID 174702524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).