1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol

C9H13BrN2O — CID 117249197

IUPAC1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol
SMILESCCc1nc(Br)c2n1CCC(O)C2
InChIInChI=1S/C9H13BrN2O/c1-2-8-11-9(10)7-5-6(13)3-4-12(7)8/h6,13H,2-5H2,1H3
InChIKeyDUTZUAMZRKAZSV-UHFFFAOYSA-N
MW245.12 g/mol
LogP1.52
Rot. Bonds1

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

1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol (PubChem CID 117249197) has the molecular formula C9H13BrN2O and a molecular weight of 245.12 g/mol. Its IUPAC name is 1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol.

Molecular Properties

Compound Name1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol
PubChem CID117249197
Molecular FormulaC9H13BrN2O
Molecular Weight245.12 g/mol
Exact Mass244.02
IUPAC Name1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol
SMILESCCc1nc(Br)c2n1CCC(O)C2
InChIInChI=1S/C9H13BrN2O/c1-2-8-11-9(10)7-5-6(13)3-4-12(7)8/h6,13H,2-5H2,1H3
InChIKeyDUTZUAMZRKAZSV-UHFFFAOYSA-N
XLogP1.52
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.12
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol?
The IUPAC name of 1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol (CID 117249197) is 1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol.
What is the SMILES notation for 1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol?
The canonical SMILES for 1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol is CCc1nc(Br)c2n1CCC(O)C2.
What is the InChIKey of 1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol?
The InChIKey is DUTZUAMZRKAZSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13BrN2O/c1-2-8-11-9(10)7-5-6(13)3-4-12(7)8/h6,13H,2-5H2,1H3.
What are the key properties of 1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol?
1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol has a molecular weight of 245.12 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-ol is sourced from PubChem (CID 117249197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).