5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride

C13H14BrClN2 — CID 14097197

IUPAC5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride
SMILESBrc1ccc(C2CCCc3cncn32)cc1.Cl
InChIInChI=1S/C13H13BrN2.ClH/c14-11-6-4-10(5-7-11)13-3-1-2-12-8-15-9-16(12)13;/h4-9,13H,1-3H2;1H
InChIKeyDAINDROYWUCDAS-UHFFFAOYSA-N
MW313.63 g/mol
LogP3.99
Rot. Bonds1

About 5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride

5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride (PubChem CID 14097197) has the molecular formula C13H14BrClN2 and a molecular weight of 313.63 g/mol. Its IUPAC name is 5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride.

Molecular Properties

Compound Name5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride
PubChem CID14097197
Molecular FormulaC13H14BrClN2
Molecular Weight313.63 g/mol
Exact Mass312.00
IUPAC Name5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride
SMILESBrc1ccc(C2CCCc3cncn32)cc1.Cl
InChIInChI=1S/C13H13BrN2.ClH/c14-11-6-4-10(5-7-11)13-3-1-2-12-8-15-9-16(12)13;/h4-9,13H,1-3H2;1H
InChIKeyDAINDROYWUCDAS-UHFFFAOYSA-N
XLogP3.99
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.63
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride?
The IUPAC name of 5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride (CID 14097197) is 5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride.
What is the SMILES notation for 5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride?
The canonical SMILES for 5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride is Brc1ccc(C2CCCc3cncn32)cc1.Cl.
What is the InChIKey of 5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride?
The InChIKey is DAINDROYWUCDAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13BrN2.ClH/c14-11-6-4-10(5-7-11)13-3-1-2-12-8-15-9-16(12)13;/h4-9,13H,1-3H2;1H.
What are the key properties of 5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride?
5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride has a molecular weight of 313.63 g/mol, XLogP of 3.99, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;hydrochloride is sourced from PubChem (CID 14097197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).