4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide

C16H18N2O3 — CID 81299836

IUPAC4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
SMILES[H]/N=C(\N)c1ccc(OC)cc1Oc1ccc(C)cc1OC
InChIInChI=1S/C16H18N2O3/c1-10-4-7-13(15(8-10)20-3)21-14-9-11(19-2)5-6-12(14)16(17)18/h4-9H,1-3H3,(H3,17,18)
InChIKeyNJYGGWWYJCRMKS-UHFFFAOYSA-N
MW286.33 g/mol
LogP3.09
Rot. Bonds5

About 4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide

4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide (PubChem CID 81299836) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide.

Molecular Properties

Compound Name4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
PubChem CID81299836
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
SMILES[H]/N=C(\N)c1ccc(OC)cc1Oc1ccc(C)cc1OC
InChIInChI=1S/C16H18N2O3/c1-10-4-7-13(15(8-10)20-3)21-14-9-11(19-2)5-6-12(14)16(17)18/h4-9H,1-3H3,(H3,17,18)
InChIKeyNJYGGWWYJCRMKS-UHFFFAOYSA-N
XLogP3.09
TPSA77.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 53.09
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
4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 63093366
4-bromo-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 114904752
2-methoxy-4-methylbenzenecarboximidamide
CID 62306767
2,4-dimethoxybenzenecarboximidamide
CID 4138242
4-methyl-2-(4-methylphenoxy)benzenecarboximidamide
CID 62308678
2-(2,4-dichlorophenoxy)-4-methoxybenzenecarboximidamide
CID 81302946
2-bromo-3-fluoro-4-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 107536673
2-(2-bromo-4-methoxyphenoxy)-5-methylbenzenecarboximidamide
CID 107930880
2-(4-fluorophenoxy)-4-methylbenzenecarboximidamide
CID 62308673
2-(4-bromo-2-fluorophenoxy)-4-methoxybenzenecarboximidamide
CID 81303138
2-(4-ethoxyphenoxy)-4-methylbenzenecarboximidamide
CID 62307304

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide?
The IUPAC name of 4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide (CID 81299836) is 4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide.
What is the SMILES notation for 4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide?
The canonical SMILES for 4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide is [H]/N=C(\N)c1ccc(OC)cc1Oc1ccc(C)cc1OC.
What is the InChIKey of 4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide?
The InChIKey is NJYGGWWYJCRMKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-10-4-7-13(15(8-10)20-3)21-14-9-11(19-2)5-6-12(14)16(17)18/h4-9H,1-3H3,(H3,17,18).
What are the key properties of 4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide?
4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide has a molecular weight of 286.33 g/mol, XLogP of 3.09, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide is sourced from PubChem (CID 81299836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).