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

C15H15ClN2O2 — CID 63093366

IUPAC4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
SMILES[H]/N=C(\N)c1ccc(Cl)cc1Oc1ccc(C)cc1OC
InChIInChI=1S/C15H15ClN2O2/c1-9-3-6-12(14(7-9)19-2)20-13-8-10(16)4-5-11(13)15(17)18/h3-8H,1-2H3,(H3,17,18)
InChIKeyLASPHDQNZKPBMC-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.73
Rot. Bonds4

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

4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide (PubChem CID 63093366) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide.

Molecular Properties

Compound Name4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
PubChem CID63093366
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
SMILES[H]/N=C(\N)c1ccc(Cl)cc1Oc1ccc(C)cc1OC
InChIInChI=1S/C15H15ClN2O2/c1-9-3-6-12(14(7-9)19-2)20-13-8-10(16)4-5-11(13)15(17)18/h3-8H,1-2H3,(H3,17,18)
InChIKeyLASPHDQNZKPBMC-UHFFFAOYSA-N
XLogP3.73
TPSA68.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.73
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'}

Analyze 4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-chloro-2-(2-fluoro-5-methylphenoxy)benzenecarboximidamide
CID 64855794
4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 81299836
4-bromo-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 114904752
4-chloro-2-methoxybenzenecarboximidamide
CID 63093709
2-methoxy-4-methylbenzenecarboximidamide
CID 62306767
2-(2,4-dichlorophenoxy)-4-methoxybenzenecarboximidamide
CID 81302946
2-(5-chloro-2-methylphenoxy)-5-methylbenzenecarboximidamide
CID 107930851
4-chloro-2-(4-methoxyphenoxy)benzenecarboximidamide
CID 63093186
4-chloro-2-(3,5-dimethoxyphenoxy)benzenecarboximidamide
CID 63094563
2-bromo-3-fluoro-4-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 107536673
2-(4-bromo-2,5-dichlorophenoxy)-4-methylbenzenecarboximidamide
CID 107658488
2-(2,3-dichlorophenoxy)-4-methylbenzenecarboximidamide
CID 55057065

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide?
The IUPAC name of 4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide (CID 63093366) is 4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide.
What is the SMILES notation for 4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide?
The canonical SMILES for 4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide is [H]/N=C(\N)c1ccc(Cl)cc1Oc1ccc(C)cc1OC.
What is the InChIKey of 4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide?
The InChIKey is LASPHDQNZKPBMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-9-3-6-12(14(7-9)19-2)20-13-8-10(16)4-5-11(13)15(17)18/h3-8H,1-2H3,(H3,17,18).
What are the key properties of 4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide?
4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide has a molecular weight of 290.75 g/mol, XLogP of 3.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide is sourced from PubChem (CID 63093366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).