1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol

C10H15BrN2O — CID 117249250

IUPAC1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol
SMILESCC(C)c1nc(Br)c2n1CCC(O)C2
InChIInChI=1S/C10H15BrN2O/c1-6(2)10-12-9(11)8-5-7(14)3-4-13(8)10/h6-7,14H,3-5H2,1-2H3
InChIKeyAOGSNPLRXCPDSY-UHFFFAOYSA-N
MW259.15 g/mol
LogP2.08
Rot. Bonds1

About 1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol

1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol (PubChem CID 117249250) has the molecular formula C10H15BrN2O and a molecular weight of 259.15 g/mol. Its IUPAC name is 1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol.

Molecular Properties

Compound Name1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol
PubChem CID117249250
Molecular FormulaC10H15BrN2O
Molecular Weight259.15 g/mol
Exact Mass258.04
IUPAC Name1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol
SMILESCC(C)c1nc(Br)c2n1CCC(O)C2
InChIInChI=1S/C10H15BrN2O/c1-6(2)10-12-9(11)8-5-7(14)3-4-13(8)10/h6-7,14H,3-5H2,1-2H3
InChIKeyAOGSNPLRXCPDSY-UHFFFAOYSA-N
XLogP2.08
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.15
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol?
The IUPAC name of 1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol (CID 117249250) is 1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol.
What is the SMILES notation for 1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol?
The canonical SMILES for 1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol is CC(C)c1nc(Br)c2n1CCC(O)C2.
What is the InChIKey of 1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol?
The InChIKey is AOGSNPLRXCPDSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN2O/c1-6(2)10-12-9(11)8-5-7(14)3-4-13(8)10/h6-7,14H,3-5H2,1-2H3.
What are the key properties of 1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol?
1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol has a molecular weight of 259.15 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol is sourced from PubChem (CID 117249250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).