1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

C7H9BrN2 — CID 83880836

IUPAC1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESBrc1ncn2c1CCCC2
InChIInChI=1S/C7H9BrN2/c8-7-6-3-1-2-4-10(6)5-9-7/h5H,1-4H2
InChIKeyYOKUXJMLZSXEHU-UHFFFAOYSA-N
MW201.07 g/mol
LogP1.98
Rot. Bonds

About 1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 83880836) has the molecular formula C7H9BrN2 and a molecular weight of 201.07 g/mol. Its IUPAC name is 1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID83880836
Molecular FormulaC7H9BrN2
Molecular Weight201.07 g/mol
Exact Mass199.99
IUPAC Name1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESBrc1ncn2c1CCCC2
InChIInChI=1S/C7H9BrN2/c8-7-6-3-1-2-4-10(6)5-9-7/h5H,1-4H2
InChIKeyYOKUXJMLZSXEHU-UHFFFAOYSA-N
XLogP1.98
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.07
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 83880836) is 1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is Brc1ncn2c1CCCC2.
What is the InChIKey of 1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is YOKUXJMLZSXEHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9BrN2/c8-7-6-3-1-2-4-10(6)5-9-7/h5H,1-4H2.
What are the key properties of 1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 201.07 g/mol, XLogP of 1.98, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 83880836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).