2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide

C15H17N3O2 — CID 114769347

IUPAC2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(Oc2cccc(COC)c2)c1
InChIInChI=1S/C15H17N3O2/c1-10-6-12(15(16)17)8-14(18-10)20-13-5-3-4-11(7-13)9-19-2/h3-8H,9H2,1-2H3,(H3,16,17)
InChIKeyOLYWKHWYLCYLCW-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.61
Rot. Bonds5

About 2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide

2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide (PubChem CID 114769347) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide.

Molecular Properties

Compound Name2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide
PubChem CID114769347
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(Oc2cccc(COC)c2)c1
InChIInChI=1S/C15H17N3O2/c1-10-6-12(15(16)17)8-14(18-10)20-13-5-3-4-11(7-13)9-19-2/h3-8H,9H2,1-2H3,(H3,16,17)
InChIKeyOLYWKHWYLCYLCW-UHFFFAOYSA-N
XLogP2.61
TPSA81.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.61
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

2-methyl-6-phenylmethoxypyridine-4-carboximidamide
CID 114769208
2-(3,5-difluorophenoxy)-6-methylpyridine-4-carboximidamide
CID 114769335
2-methyl-6-(3-methyl-4-propan-2-ylphenoxy)pyridine-4-carboximidamide
CID 114769248
2-(2-ethoxyphenoxy)-6-methylpyridine-4-carboximidamide
CID 114769243
2-fluoro-6-[3-(methoxymethyl)phenoxy]benzenecarboximidamide
CID 79523185
4-chloro-6-[3-(methoxymethyl)phenoxy]-2-methylpyrimidine
CID 63986769
6-[3-(methoxymethyl)phenoxy]pyridine-2-carbothioamide
CID 64593563
2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carboximidamide
CID 114769321
4-[3-(methoxymethyl)phenoxy]-6-methyl-N-propylpyrimidin-2-amine
CID 80880224
2-[3-(methoxymethyl)phenoxy]-5-methylpyridine
CID 123576631
2-(4-chloro-2,6-dimethylphenoxy)-6-methylpyridine-4-carboximidamide
CID 114769235
6-(3-methylphenoxy)pyridine-3-carboximidamide
CID 24705712

Frequently Asked Questions

What is the IUPAC name of 2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide?
The IUPAC name of 2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide (CID 114769347) is 2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide.
What is the SMILES notation for 2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide?
The canonical SMILES for 2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide is [H]/N=C(\N)c1cc(C)nc(Oc2cccc(COC)c2)c1.
What is the InChIKey of 2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide?
The InChIKey is OLYWKHWYLCYLCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-6-12(15(16)17)8-14(18-10)20-13-5-3-4-11(7-13)9-19-2/h3-8H,9H2,1-2H3,(H3,16,17).
What are the key properties of 2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide?
2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide has a molecular weight of 271.32 g/mol, XLogP of 2.61, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide is sourced from PubChem (CID 114769347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).