2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide

C12H14N4 — CID 83886367

IUPAC2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide
SMILES[H]/N=C(\N)Cc1nc(C2CC2)n2ccccc12
InChIInChI=1S/C12H14N4/c13-11(14)7-9-10-3-1-2-6-16(10)12(15-9)8-4-5-8/h1-3,6,8H,4-5,7H2,(H3,13,14)
InChIKeyCJATYGIBSUIDEF-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.69
Rot. Bonds3

About 2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide

2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide (PubChem CID 83886367) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is 2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide.

Molecular Properties

Compound Name2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide
PubChem CID83886367
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide
SMILES[H]/N=C(\N)Cc1nc(C2CC2)n2ccccc12
InChIInChI=1S/C12H14N4/c13-11(14)7-9-10-3-1-2-6-16(10)12(15-9)8-4-5-8/h1-3,6,8H,4-5,7H2,(H3,13,14)
InChIKeyCJATYGIBSUIDEF-UHFFFAOYSA-N
XLogP1.69
TPSA67.17 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.69
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 2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide?
The IUPAC name of 2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide (CID 83886367) is 2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide.
What is the SMILES notation for 2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide?
The canonical SMILES for 2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide is [H]/N=C(\N)Cc1nc(C2CC2)n2ccccc12.
What is the InChIKey of 2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide?
The InChIKey is CJATYGIBSUIDEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c13-11(14)7-9-10-3-1-2-6-16(10)12(15-9)8-4-5-8/h1-3,6,8H,4-5,7H2,(H3,13,14).
What are the key properties of 2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide?
2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide has a molecular weight of 214.27 g/mol, XLogP of 1.69, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)ethanimidamide is sourced from PubChem (CID 83886367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).