8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide

C8H7ClN4O — CID 83885242

IUPAC8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide
SMILESN/C(=N/O)c1cn2cccc(Cl)c2n1
InChIInChI=1S/C8H7ClN4O/c9-5-2-1-3-13-4-6(7(10)12-14)11-8(5)13/h1-4,14H,(H2,10,12)
InChIKeyQCKSFVKLQNDDGI-UHFFFAOYSA-N
MW210.62 g/mol
LogP1.08
Rot. Bonds1

About 8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide

8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide (PubChem CID 83885242) has the molecular formula C8H7ClN4O and a molecular weight of 210.62 g/mol. Its IUPAC name is 8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide.

Molecular Properties

Compound Name8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide
PubChem CID83885242
Molecular FormulaC8H7ClN4O
Molecular Weight210.62 g/mol
Exact Mass210.03
IUPAC Name8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide
SMILESN/C(=N/O)c1cn2cccc(Cl)c2n1
InChIInChI=1S/C8H7ClN4O/c9-5-2-1-3-13-4-6(7(10)12-14)11-8(5)13/h1-4,14H,(H2,10,12)
InChIKeyQCKSFVKLQNDDGI-UHFFFAOYSA-N
XLogP1.08
TPSA75.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.62
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide?
The IUPAC name of 8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide (CID 83885242) is 8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide.
What is the SMILES notation for 8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide?
The canonical SMILES for 8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide is N/C(=N/O)c1cn2cccc(Cl)c2n1.
What is the InChIKey of 8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide?
The InChIKey is QCKSFVKLQNDDGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClN4O/c9-5-2-1-3-13-4-6(7(10)12-14)11-8(5)13/h1-4,14H,(H2,10,12).
What are the key properties of 8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide?
8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide has a molecular weight of 210.62 g/mol, XLogP of 1.08, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-N'-hydroxyimidazo[1,2-a]pyridine-2-carboximidamide is sourced from PubChem (CID 83885242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).