2-methyl-6-phenylmethoxypyridine-4-carboximidamide

C14H15N3O — CID 114769208

IUPAC2-methyl-6-phenylmethoxypyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(OCc2ccccc2)c1
InChIInChI=1S/C14H15N3O/c1-10-7-12(14(15)16)8-13(17-10)18-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H3,15,16)
InChIKeyDOTWHTDRQOTGAA-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.25
Rot. Bonds4

About 2-methyl-6-phenylmethoxypyridine-4-carboximidamide

2-methyl-6-phenylmethoxypyridine-4-carboximidamide (PubChem CID 114769208) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-methyl-6-phenylmethoxypyridine-4-carboximidamide.

Molecular Properties

Compound Name2-methyl-6-phenylmethoxypyridine-4-carboximidamide
PubChem CID114769208
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name2-methyl-6-phenylmethoxypyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(OCc2ccccc2)c1
InChIInChI=1S/C14H15N3O/c1-10-7-12(14(15)16)8-13(17-10)18-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H3,15,16)
InChIKeyDOTWHTDRQOTGAA-UHFFFAOYSA-N
XLogP2.25
TPSA71.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.25
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

2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carboximidamide
CID 114769321
2-(2-ethoxyphenoxy)-6-methylpyridine-4-carboximidamide
CID 114769243
2-[3-(methoxymethyl)phenoxy]-6-methylpyridine-4-carboximidamide
CID 114769347
2-methyl-6-pentoxypyridine-4-carboximidamide
CID 114769287
2-[2-(dimethylamino)-2-methylpropoxy]-6-methylpyridine-4-carboximidamide
CID 114769367
1-(4-methyl-6-phenylmethoxypyrimidin-2-yl)ethanone
CID 170640785
2-(3,5-difluorophenoxy)-6-methylpyridine-4-carboximidamide
CID 114769335
3-[(2-methylphenoxy)methyl]benzenecarboximidamide
CID 24701017
2-(4-chloro-2,6-dimethylphenoxy)-6-methylpyridine-4-carboximidamide
CID 114769235
1-hydroxy-6-methyl-4-phenylmethoxypyrimidin-2-imine
CID 19085616
2,6-dimethyl-4-(3-phenylpropoxy)pyridine-3-carboximidamide
CID 81036918
2-(1,3-benzodioxol-5-ylmethoxy)-6-methylpyridine-4-carbothioamide
CID 114768074

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-phenylmethoxypyridine-4-carboximidamide?
The IUPAC name of 2-methyl-6-phenylmethoxypyridine-4-carboximidamide (CID 114769208) is 2-methyl-6-phenylmethoxypyridine-4-carboximidamide.
What is the SMILES notation for 2-methyl-6-phenylmethoxypyridine-4-carboximidamide?
The canonical SMILES for 2-methyl-6-phenylmethoxypyridine-4-carboximidamide is [H]/N=C(\N)c1cc(C)nc(OCc2ccccc2)c1.
What is the InChIKey of 2-methyl-6-phenylmethoxypyridine-4-carboximidamide?
The InChIKey is DOTWHTDRQOTGAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-10-7-12(14(15)16)8-13(17-10)18-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H3,15,16).
What are the key properties of 2-methyl-6-phenylmethoxypyridine-4-carboximidamide?
2-methyl-6-phenylmethoxypyridine-4-carboximidamide has a molecular weight of 241.29 g/mol, XLogP of 2.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-phenylmethoxypyridine-4-carboximidamide is sourced from PubChem (CID 114769208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).