2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide

C14H14FN3O — CID 64855988

IUPAC2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(C)nc1Oc1cc(C)ccc1F
InChIInChI=1S/C14H14FN3O/c1-8-3-6-11(15)12(7-8)19-14-10(13(16)17)5-4-9(2)18-14/h3-7H,1-2H3,(H3,16,17)
InChIKeySWZSZPLZYZIYBW-UHFFFAOYSA-N
MW259.28 g/mol
LogP2.91
Rot. Bonds3

About 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide

2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide (PubChem CID 64855988) has the molecular formula C14H14FN3O and a molecular weight of 259.28 g/mol. Its IUPAC name is 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide.

Molecular Properties

Compound Name2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide
PubChem CID64855988
Molecular FormulaC14H14FN3O
Molecular Weight259.28 g/mol
Exact Mass259.11
IUPAC Name2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(C)nc1Oc1cc(C)ccc1F
InChIInChI=1S/C14H14FN3O/c1-8-3-6-11(15)12(7-8)19-14-10(13(16)17)5-4-9(2)18-14/h3-7H,1-2H3,(H3,16,17)
InChIKeySWZSZPLZYZIYBW-UHFFFAOYSA-N
XLogP2.91
TPSA71.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 52.91
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-(2-fluoro-5-methylphenoxy)-5-methylbenzenecarboximidamide
CID 107930844
4-chloro-2-(2-fluoro-5-methylphenoxy)benzenecarboximidamide
CID 64855794
2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid
CID 64856053
2-(2,5-difluorophenoxy)-4,6-dimethylpyridine-3-carboximidamide
CID 63269866
6-(2-fluoro-5-methylphenoxy)pyridine-3-carboximidamide
CID 64855796
[2-(2-fluoro-5-methylphenoxy)-6-methyl-3-pyridinyl]methanamine
CID 64853407
2-(4-fluorophenoxy)-4-methylbenzenecarboximidamide
CID 62308673
2-methoxy-4-methylbenzenecarboximidamide
CID 62306767
4-methyl-2-(4-methylphenoxy)benzenecarboximidamide
CID 62308678
3-(2,5-difluorophenoxy)-5,6-dimethylpyridazine-4-carboximidamide
CID 63269865
4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 63093366
2-(3-bromo-5-fluorophenoxy)-4-methylbenzenecarboximidamide
CID 81332379

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide?
The IUPAC name of 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide (CID 64855988) is 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide.
What is the SMILES notation for 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide?
The canonical SMILES for 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide is [H]/N=C(\N)c1ccc(C)nc1Oc1cc(C)ccc1F.
What is the InChIKey of 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide?
The InChIKey is SWZSZPLZYZIYBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O/c1-8-3-6-11(15)12(7-8)19-14-10(13(16)17)5-4-9(2)18-14/h3-7H,1-2H3,(H3,16,17).
What are the key properties of 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide?
2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide has a molecular weight of 259.28 g/mol, XLogP of 2.91, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide is sourced from PubChem (CID 64855988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).