5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide

C13H17N5 — CID 115489730

IUPAC5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1ccc(-n2nc(C)c(CC)c2C)cn1
InChIInChI=1S/C13H17N5/c1-4-11-8(2)17-18(9(11)3)10-5-6-12(13(14)15)16-7-10/h5-7H,4H2,1-3H3,(H3,14,15)
InChIKeyBXAMJMYFRHNWRS-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.73
Rot. Bonds3

About 5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide

5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide (PubChem CID 115489730) has the molecular formula C13H17N5 and a molecular weight of 243.31 g/mol. Its IUPAC name is 5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide.

Molecular Properties

Compound Name5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide
PubChem CID115489730
Molecular FormulaC13H17N5
Molecular Weight243.31 g/mol
Exact Mass243.15
IUPAC Name5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1ccc(-n2nc(C)c(CC)c2C)cn1
InChIInChI=1S/C13H17N5/c1-4-11-8(2)17-18(9(11)3)10-5-6-12(13(14)15)16-7-10/h5-7H,4H2,1-3H3,(H3,14,15)
InChIKeyBXAMJMYFRHNWRS-UHFFFAOYSA-N
XLogP1.73
TPSA80.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.73
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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Related Compounds

5-(4-bromo-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide
CID 115489734
5-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide
CID 115489724
2-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-3-carboximidamide
CID 61239198
2-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-4-carboximidamide
CID 61236499
5-(2-ethylimidazol-1-yl)pyridine-2-carboximidamide
CID 115489732
5-(2-methylimidazol-1-yl)pyridine-2-carboximidamide
CID 115489725
5-(N-ethyl-4-methylanilino)pyridine-2-carboximidamide
CID 115489614
1-(4-chlorophenyl)-4-ethyl-3,5-dimethylpyrazole
CID 50888250
4-[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)ethoxy]benzenecarboximidamide
CID 61299238
5-(3,3-diethylpyrrolidin-1-yl)pyridine-2-carboximidamide
CID 115489708
N-[1-[5-(4-ethyl-3,5-dimethylpyrazol-1-yl)-2-pyridinyl]ethyl]propan-1-amine
CID 83109750
5-methoxypyridine-2-carboximidamide;hydrochloride
CID 53484941

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide?
The IUPAC name of 5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide (CID 115489730) is 5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide.
What is the SMILES notation for 5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide?
The canonical SMILES for 5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide is [H]/N=C(\N)c1ccc(-n2nc(C)c(CC)c2C)cn1.
What is the InChIKey of 5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide?
The InChIKey is BXAMJMYFRHNWRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5/c1-4-11-8(2)17-18(9(11)3)10-5-6-12(13(14)15)16-7-10/h5-7H,4H2,1-3H3,(H3,14,15).
What are the key properties of 5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide?
5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide has a molecular weight of 243.31 g/mol, XLogP of 1.73, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyridine-2-carboximidamide is sourced from PubChem (CID 115489730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).