6-bromo-2-methylindolizine

C9H8BrN — CID 83679046

IUPAC6-bromo-2-methylindolizine
SMILESCc1cc2ccc(Br)cn2c1
InChIInChI=1S/C9H8BrN/c1-7-4-9-3-2-8(10)6-11(9)5-7/h2-6H,1H3
InChIKeyHHCNEOLXSWRNFA-UHFFFAOYSA-N
MW210.07 g/mol
LogP3.01
Rot. Bonds

About 6-bromo-2-methylindolizine

6-bromo-2-methylindolizine (PubChem CID 83679046) has the molecular formula C9H8BrN and a molecular weight of 210.07 g/mol. Its IUPAC name is 6-bromo-2-methylindolizine.

Molecular Properties

Compound Name6-bromo-2-methylindolizine
PubChem CID83679046
Molecular FormulaC9H8BrN
Molecular Weight210.07 g/mol
Exact Mass208.98
IUPAC Name6-bromo-2-methylindolizine
SMILESCc1cc2ccc(Br)cn2c1
InChIInChI=1S/C9H8BrN/c1-7-4-9-3-2-8(10)6-11(9)5-7/h2-6H,1H3
InChIKeyHHCNEOLXSWRNFA-UHFFFAOYSA-N
XLogP3.01
TPSA4.41 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.07
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-methylindolizine?
The IUPAC name of 6-bromo-2-methylindolizine (CID 83679046) is 6-bromo-2-methylindolizine.
What is the SMILES notation for 6-bromo-2-methylindolizine?
The canonical SMILES for 6-bromo-2-methylindolizine is Cc1cc2ccc(Br)cn2c1.
What is the InChIKey of 6-bromo-2-methylindolizine?
The InChIKey is HHCNEOLXSWRNFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrN/c1-7-4-9-3-2-8(10)6-11(9)5-7/h2-6H,1H3.
What are the key properties of 6-bromo-2-methylindolizine?
6-bromo-2-methylindolizine has a molecular weight of 210.07 g/mol, XLogP of 3.01, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-methylindolizine is sourced from PubChem (CID 83679046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).