3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine

C10H7IN4 — CID 126648319

IUPAC3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine
SMILESIc1cnc2ccc(-c3cn[nH]c3)cn12
InChIInChI=1S/C10H7IN4/c11-9-5-12-10-2-1-7(6-15(9)10)8-3-13-14-4-8/h1-6H,(H,13,14)
InChIKeyNLXBGJNJQBBVRJ-UHFFFAOYSA-N
MW310.10 g/mol
LogP2.33
Rot. Bonds1

About 3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine

3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine (PubChem CID 126648319) has the molecular formula C10H7IN4 and a molecular weight of 310.10 g/mol. Its IUPAC name is 3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine
PubChem CID126648319
Molecular FormulaC10H7IN4
Molecular Weight310.10 g/mol
Exact Mass309.97
IUPAC Name3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine
SMILESIc1cnc2ccc(-c3cn[nH]c3)cn12
InChIInChI=1S/C10H7IN4/c11-9-5-12-10-2-1-7(6-15(9)10)8-3-13-14-4-8/h1-6H,(H,13,14)
InChIKeyNLXBGJNJQBBVRJ-UHFFFAOYSA-N
XLogP2.33
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.10
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine (CID 126648319) is 3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine is Ic1cnc2ccc(-c3cn[nH]c3)cn12.
What is the InChIKey of 3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine?
The InChIKey is NLXBGJNJQBBVRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7IN4/c11-9-5-12-10-2-1-7(6-15(9)10)8-3-13-14-4-8/h1-6H,(H,13,14).
What are the key properties of 3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine?
3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine has a molecular weight of 310.10 g/mol, XLogP of 2.33, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-iodo-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 126648319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).