5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

C11H13N3 — CID 68622872

IUPAC5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESc1cc(C2CCCc3cncn32)c[nH]1
InChIInChI=1S/C11H13N3/c1-2-10-7-13-8-14(10)11(3-1)9-4-5-12-6-9/h4-8,11-12H,1-3H2
InChIKeyDEZLNYIVQGPQIQ-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.14
Rot. Bonds1

About 5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 68622872) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID68622872
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESc1cc(C2CCCc3cncn32)c[nH]1
InChIInChI=1S/C11H13N3/c1-2-10-7-13-8-14(10)11(3-1)9-4-5-12-6-9/h4-8,11-12H,1-3H2
InChIKeyDEZLNYIVQGPQIQ-UHFFFAOYSA-N
XLogP2.14
TPSA33.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 68622872) is 5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is c1cc(C2CCCc3cncn32)c[nH]1.
What is the InChIKey of 5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is DEZLNYIVQGPQIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-2-10-7-13-8-14(10)11(3-1)9-4-5-12-6-9/h4-8,11-12H,1-3H2.
What are the key properties of 5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 187.25 g/mol, XLogP of 2.14, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-pyrrol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 68622872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).