3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide

C11H12N4 — CID 83880717

IUPAC3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide
SMILES[H]/N=C(\N)c1cccc2cnc(C3CC3)n12
InChIInChI=1S/C11H12N4/c12-10(13)9-3-1-2-8-6-14-11(15(8)9)7-4-5-7/h1-3,6-7H,4-5H2,(H3,12,13)
InChIKeyWOBLHMNKZGEVHW-UHFFFAOYSA-N
MW200.25 g/mol
LogP1.50
Rot. Bonds2

About 3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide

3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide (PubChem CID 83880717) has the molecular formula C11H12N4 and a molecular weight of 200.25 g/mol. Its IUPAC name is 3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide.

Molecular Properties

Compound Name3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide
PubChem CID83880717
Molecular FormulaC11H12N4
Molecular Weight200.25 g/mol
Exact Mass200.11
IUPAC Name3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide
SMILES[H]/N=C(\N)c1cccc2cnc(C3CC3)n12
InChIInChI=1S/C11H12N4/c12-10(13)9-3-1-2-8-6-14-11(15(8)9)7-4-5-7/h1-3,6-7H,4-5H2,(H3,12,13)
InChIKeyWOBLHMNKZGEVHW-UHFFFAOYSA-N
XLogP1.50
TPSA67.17 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.25
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide?
The IUPAC name of 3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide (CID 83880717) is 3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide.
What is the SMILES notation for 3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide?
The canonical SMILES for 3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide is [H]/N=C(\N)c1cccc2cnc(C3CC3)n12.
What is the InChIKey of 3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide?
The InChIKey is WOBLHMNKZGEVHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4/c12-10(13)9-3-1-2-8-6-14-11(15(8)9)7-4-5-7/h1-3,6-7H,4-5H2,(H3,12,13).
What are the key properties of 3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide?
3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide has a molecular weight of 200.25 g/mol, XLogP of 1.50, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropylimidazo[1,5-a]pyridine-5-carboximidamide is sourced from PubChem (CID 83880717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).