1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

C11H15BrN2 — CID 83844096

IUPAC1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC1CCCc2c(Br)nc(C3CC3)n21
InChIInChI=1S/C11H15BrN2/c1-7-3-2-4-9-10(12)13-11(14(7)9)8-5-6-8/h7-8H,2-6H2,1H3
InChIKeyHBSWWDPCEXBCMS-UHFFFAOYSA-N
MW255.16 g/mol
LogP3.42
Rot. Bonds1

About 1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 83844096) has the molecular formula C11H15BrN2 and a molecular weight of 255.16 g/mol. Its IUPAC name is 1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID83844096
Molecular FormulaC11H15BrN2
Molecular Weight255.16 g/mol
Exact Mass254.04
IUPAC Name1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC1CCCc2c(Br)nc(C3CC3)n21
InChIInChI=1S/C11H15BrN2/c1-7-3-2-4-9-10(12)13-11(14(7)9)8-5-6-8/h7-8H,2-6H2,1H3
InChIKeyHBSWWDPCEXBCMS-UHFFFAOYSA-N
XLogP3.42
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.16
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 83844096) is 1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is CC1CCCc2c(Br)nc(C3CC3)n21.
What is the InChIKey of 1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is HBSWWDPCEXBCMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2/c1-7-3-2-4-9-10(12)13-11(14(7)9)8-5-6-8/h7-8H,2-6H2,1H3.
What are the key properties of 1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 255.16 g/mol, XLogP of 3.42, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-cyclopropyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 83844096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).