4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide

C13H17N5O — CID 116801560

IUPAC4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1c(C)ccnc1Oc1cnn(C(C)C)c1
InChIInChI=1S/C13H17N5O/c1-8(2)18-7-10(6-17-18)19-13-11(12(14)15)9(3)4-5-16-13/h4-8H,1-3H3,(H3,14,15)
InChIKeyJSKVTDDYIBKUNZ-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.24
Rot. Bonds4

About 4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide

4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide (PubChem CID 116801560) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is 4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide.

Molecular Properties

Compound Name4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide
PubChem CID116801560
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1c(C)ccnc1Oc1cnn(C(C)C)c1
InChIInChI=1S/C13H17N5O/c1-8(2)18-7-10(6-17-18)19-13-11(12(14)15)9(3)4-5-16-13/h4-8H,1-3H3,(H3,14,15)
InChIKeyJSKVTDDYIBKUNZ-UHFFFAOYSA-N
XLogP2.24
TPSA89.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-fluoro-4-methylphenoxy)-4-methylpyridine-3-carboximidamide
CID 107169461
3-(1-propan-2-ylpyrazol-4-yl)oxypyrazin-2-amine
CID 102988441
4-methyl-2-quinolin-7-yloxypyridine-3-carboximidamide
CID 107313822
methyl 3-amino-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-4-carboxylate
CID 116802609
2-(1-ethylpyrazol-4-yl)oxy-N'-hydroxy-4-methylpyridine-3-carboximidamide
CID 116801405
3-fluoro-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-4-carboxylic acid
CID 105380111
N'-hydroxy-4-(1-propan-2-ylpyrazol-4-yl)oxypyridine-2-carboximidamide
CID 136932357
N'-hydroxy-4-(1-propan-2-ylpyrazol-4-yl)oxybenzenecarboximidamide
CID 116801466
N'-hydroxy-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-4-carboximidamide
CID 136932356
[5-methyl-6-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine
CID 116806942
6-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboxylic acid
CID 116804006
N-[[2-(1-propan-2-ylpyrazol-4-yl)oxy-3-pyridinyl]methyl]propan-1-amine
CID 116803075

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide?
The IUPAC name of 4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide (CID 116801560) is 4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide.
What is the SMILES notation for 4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide?
The canonical SMILES for 4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide is [H]/N=C(\N)c1c(C)ccnc1Oc1cnn(C(C)C)c1.
What is the InChIKey of 4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide?
The InChIKey is JSKVTDDYIBKUNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-8(2)18-7-10(6-17-18)19-13-11(12(14)15)9(3)4-5-16-13/h4-8H,1-3H3,(H3,14,15).
What are the key properties of 4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide?
4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide has a molecular weight of 259.31 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-3-carboximidamide is sourced from PubChem (CID 116801560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).