2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide

C10H11N5 — CID 24701918

IUPAC2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1cccnc1-n1ccnc1C
InChIInChI=1S/C10H11N5/c1-7-13-5-6-15(7)10-8(9(11)12)3-2-4-14-10/h2-6H,1H3,(H3,11,12)
InChIKeyXYFDFRBFHBKJFK-UHFFFAOYSA-N
MW201.23 g/mol
LogP0.86
Rot. Bonds2

About 2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide

2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide (PubChem CID 24701918) has the molecular formula C10H11N5 and a molecular weight of 201.23 g/mol. Its IUPAC name is 2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide.

Molecular Properties

Compound Name2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide
PubChem CID24701918
Molecular FormulaC10H11N5
Molecular Weight201.23 g/mol
Exact Mass201.10
IUPAC Name2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1cccnc1-n1ccnc1C
InChIInChI=1S/C10H11N5/c1-7-13-5-6-15(7)10-8(9(11)12)3-2-4-14-10/h2-6H,1H3,(H3,11,12)
InChIKeyXYFDFRBFHBKJFK-UHFFFAOYSA-N
XLogP0.86
TPSA80.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 50.86
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'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide?
The IUPAC name of 2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide (CID 24701918) is 2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide.
What is the SMILES notation for 2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide?
The canonical SMILES for 2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide is [H]/N=C(\N)c1cccnc1-n1ccnc1C.
What is the InChIKey of 2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide?
The InChIKey is XYFDFRBFHBKJFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5/c1-7-13-5-6-15(7)10-8(9(11)12)3-2-4-14-10/h2-6H,1H3,(H3,11,12).
What are the key properties of 2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide?
2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide has a molecular weight of 201.23 g/mol, XLogP of 0.86, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylimidazol-1-yl)pyridine-3-carboximidamide is sourced from PubChem (CID 24701918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).