N'-amino-2-methoxypyridine-3-carboximidamide

C7H10N4O — CID 76975295

IUPACN'-amino-2-methoxypyridine-3-carboximidamide
SMILESCOc1ncccc1C(N)=NN
InChIInChI=1S/C7H10N4O/c1-12-7-5(6(8)11-9)3-2-4-10-7/h2-4H,9H2,1H3,(H2,8,11)
InChIKeyVPIOMZDJARBOMT-UHFFFAOYSA-N
MW166.18 g/mol
LogP-0.33
Rot. Bonds2

About N'-amino-2-methoxypyridine-3-carboximidamide

N'-amino-2-methoxypyridine-3-carboximidamide (PubChem CID 76975295) has the molecular formula C7H10N4O and a molecular weight of 166.18 g/mol. Its IUPAC name is N'-amino-2-methoxypyridine-3-carboximidamide.

Molecular Properties

Compound NameN'-amino-2-methoxypyridine-3-carboximidamide
PubChem CID76975295
Molecular FormulaC7H10N4O
Molecular Weight166.18 g/mol
Exact Mass166.09
IUPAC NameN'-amino-2-methoxypyridine-3-carboximidamide
SMILESCOc1ncccc1C(N)=NN
InChIInChI=1S/C7H10N4O/c1-12-7-5(6(8)11-9)3-2-4-10-7/h2-4H,9H2,1H3,(H2,8,11)
InChIKeyVPIOMZDJARBOMT-UHFFFAOYSA-N
XLogP-0.33
TPSA86.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-hydroxy-2-(2-methoxyphenoxy)pyridine-3-carboximidamide
CID 24711030
N'-amino-2-ethylpyridine-3-carboximidamide
CID 141290958
2-methoxy-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
CID 82724055
N'-amino-2-cyanopyridine-3-carboximidamide
CID 138107943
N'-hydroxy-2-[[(2-methoxy-3-pyridinyl)methylamino]methyl]benzenecarboximidamide
CID 77026755
2-methoxypyridin-3-ol;hydrate
CID 132769884
(3,4-dimethoxyphenyl)-(2-methoxy-3-pyridinyl)methanone
CID 115605036
N'-hydroxy-2-(2,4,5-trichlorophenoxy)pyridine-3-carboximidamide
CID 43108551
N-(2-hydroxy-2-methylpropyl)-2-methoxypyridine-3-carboxamide
CID 65109453
N-(2-amino-2-hydroxyiminoethyl)-N-cyclopentyl-2-methoxypyridine-3-carboxamide
CID 77037925
2-(2-methoxyphenoxy)pyridine-3-carbothioamide
CID 24702703
methyl 2-(2-methoxypyridine-3-carbonyl)benzoate
CID 24723742

Frequently Asked Questions

What is the IUPAC name of N'-amino-2-methoxypyridine-3-carboximidamide?
The IUPAC name of N'-amino-2-methoxypyridine-3-carboximidamide (CID 76975295) is N'-amino-2-methoxypyridine-3-carboximidamide.
What is the SMILES notation for N'-amino-2-methoxypyridine-3-carboximidamide?
The canonical SMILES for N'-amino-2-methoxypyridine-3-carboximidamide is COc1ncccc1C(N)=NN.
What is the InChIKey of N'-amino-2-methoxypyridine-3-carboximidamide?
The InChIKey is VPIOMZDJARBOMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O/c1-12-7-5(6(8)11-9)3-2-4-10-7/h2-4H,9H2,1H3,(H2,8,11).
What are the key properties of N'-amino-2-methoxypyridine-3-carboximidamide?
N'-amino-2-methoxypyridine-3-carboximidamide has a molecular weight of 166.18 g/mol, XLogP of -0.33, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-amino-2-methoxypyridine-3-carboximidamide is sourced from PubChem (CID 76975295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).