4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide

C14H15N3O2 — CID 81303141

IUPAC4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide
SMILES[H]/N=C(\N)c1ccc(OC)cc1Oc1ccc(C)nc1
InChIInChI=1S/C14H15N3O2/c1-9-3-4-11(8-17-9)19-13-7-10(18-2)5-6-12(13)14(15)16/h3-8H,1-2H3,(H3,15,16)
InChIKeyOEHNHUUBMKXGNG-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.47
Rot. Bonds4

About 4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide

4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide (PubChem CID 81303141) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide.

Molecular Properties

Compound Name4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide
PubChem CID81303141
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide
SMILES[H]/N=C(\N)c1ccc(OC)cc1Oc1ccc(C)nc1
InChIInChI=1S/C14H15N3O2/c1-9-3-4-11(8-17-9)19-13-7-10(18-2)5-6-12(13)14(15)16/h3-8H,1-2H3,(H3,15,16)
InChIKeyOEHNHUUBMKXGNG-UHFFFAOYSA-N
XLogP2.47
TPSA81.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.47
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

4-methoxy-2-(4-methylphenoxy)benzenecarboximidamide
CID 81302853
2,4-dimethoxybenzenecarboximidamide
CID 4138242
4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 81299836
2-butoxy-4-methoxybenzenecarboximidamide
CID 81302951
4-methoxy-2-propoxybenzenecarboximidamide;hydrochloride
CID 21250754
4-chloro-2-(4-methoxyphenoxy)benzenecarboximidamide
CID 63093186
4-methoxy-2-[(4-methoxyphenyl)methoxy]benzenecarboximidamide
CID 81300051
4-methyl-2-(4-methylphenoxy)benzenecarboximidamide
CID 62308678
2-(2,4-dichlorophenoxy)-4-methoxybenzenecarboximidamide
CID 81302946
4-chloro-2-(3,5-dimethoxyphenoxy)benzenecarboximidamide
CID 63094563
2-(5-bromo-2-chlorophenoxy)-4-methoxybenzenecarboximidamide
CID 81303045
2-(4-bromo-2-fluorophenoxy)-4-methoxybenzenecarboximidamide
CID 81303138

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide?
The IUPAC name of 4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide (CID 81303141) is 4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide.
What is the SMILES notation for 4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide?
The canonical SMILES for 4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide is [H]/N=C(\N)c1ccc(OC)cc1Oc1ccc(C)nc1.
What is the InChIKey of 4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide?
The InChIKey is OEHNHUUBMKXGNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-9-3-4-11(8-17-9)19-13-7-10(18-2)5-6-12(13)14(15)16/h3-8H,1-2H3,(H3,15,16).
What are the key properties of 4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide?
4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide has a molecular weight of 257.29 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide is sourced from PubChem (CID 81303141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).