5-methoxypyridine-2-carboximidamide;hydrochloride

C7H10ClN3O — CID 53484941

IUPAC5-methoxypyridine-2-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1ccc(OC)cn1
InChIInChI=1S/C7H9N3O.ClH/c1-11-5-2-3-6(7(8)9)10-4-5;/h2-4H,1H3,(H3,8,9);1H
InChIKeyAKXGSCNOQOBHDQ-UHFFFAOYSA-N
MW187.63 g/mol
LogP0.80
Rot. Bonds2

About 5-methoxypyridine-2-carboximidamide;hydrochloride

5-methoxypyridine-2-carboximidamide;hydrochloride (PubChem CID 53484941) has the molecular formula C7H10ClN3O and a molecular weight of 187.63 g/mol. Its IUPAC name is 5-methoxypyridine-2-carboximidamide;hydrochloride.

Molecular Properties

Compound Name5-methoxypyridine-2-carboximidamide;hydrochloride
PubChem CID53484941
Molecular FormulaC7H10ClN3O
Molecular Weight187.63 g/mol
Exact Mass187.05
IUPAC Name5-methoxypyridine-2-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1ccc(OC)cn1
InChIInChI=1S/C7H9N3O.ClH/c1-11-5-2-3-6(7(8)9)10-4-5;/h2-4H,1H3,(H3,8,9);1H
InChIKeyAKXGSCNOQOBHDQ-UHFFFAOYSA-N
XLogP0.80
TPSA71.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.63
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-2-carboximidamide
CID 104562334
5-(4-ethoxyphenoxy)pyridine-2-carboximidamide
CID 115489787
5-[3-(4-carbamimidoylphenoxy)propoxy]pyridine-2-carboximidamide
CID 150821261
5-(5-methoxy-2-nitrophenoxy)pyridine-2-carboximidamide
CID 102702745
5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide
CID 113321289
5-(2-methylphenoxy)pyridine-2-carboximidamide
CID 113321278
N'-hydroxy-5-methoxypyridine-2-carboximidamide
CID 135743705
5-(3-tert-butylphenoxy)pyridine-2-carboximidamide
CID 115489822
N',5-dimethoxypyridine-2-carboximidamide
CID 123379844
4-[(4-methoxyphenyl)methoxymethyl]pyridine-2-carboximidamide
CID 63882445
5-(propan-2-ylamino)pyridine-2-carboximidamide
CID 115489626
2-bromo-2-(5-methoxy-2-pyridinyl)ethenamine
CID 164558820

Frequently Asked Questions

What is the IUPAC name of 5-methoxypyridine-2-carboximidamide;hydrochloride?
The IUPAC name of 5-methoxypyridine-2-carboximidamide;hydrochloride (CID 53484941) is 5-methoxypyridine-2-carboximidamide;hydrochloride.
What is the SMILES notation for 5-methoxypyridine-2-carboximidamide;hydrochloride?
The canonical SMILES for 5-methoxypyridine-2-carboximidamide;hydrochloride is Cl.[H]/N=C(\N)c1ccc(OC)cn1.
What is the InChIKey of 5-methoxypyridine-2-carboximidamide;hydrochloride?
The InChIKey is AKXGSCNOQOBHDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O.ClH/c1-11-5-2-3-6(7(8)9)10-4-5;/h2-4H,1H3,(H3,8,9);1H.
What are the key properties of 5-methoxypyridine-2-carboximidamide;hydrochloride?
5-methoxypyridine-2-carboximidamide;hydrochloride has a molecular weight of 187.63 g/mol, XLogP of 0.80, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxypyridine-2-carboximidamide;hydrochloride is sourced from PubChem (CID 53484941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).