4-methyl-2-(4-methylphenoxy)benzenecarboximidamide

C15H16N2O — CID 62308678

IUPAC4-methyl-2-(4-methylphenoxy)benzenecarboximidamide
SMILES[H]/N=C(\N)c1ccc(C)cc1Oc1ccc(C)cc1
InChIInChI=1S/C15H16N2O/c1-10-3-6-12(7-4-10)18-14-9-11(2)5-8-13(14)15(16)17/h3-9H,1-2H3,(H3,16,17)
InChIKeyGSNWJPNKXPPYME-UHFFFAOYSA-N
MW240.31 g/mol
LogP3.38
Rot. Bonds3

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

4-methyl-2-(4-methylphenoxy)benzenecarboximidamide (PubChem CID 62308678) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 4-methyl-2-(4-methylphenoxy)benzenecarboximidamide.

Molecular Properties

Compound Name4-methyl-2-(4-methylphenoxy)benzenecarboximidamide
PubChem CID62308678
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name4-methyl-2-(4-methylphenoxy)benzenecarboximidamide
SMILES[H]/N=C(\N)c1ccc(C)cc1Oc1ccc(C)cc1
InChIInChI=1S/C15H16N2O/c1-10-3-6-12(7-4-10)18-14-9-11(2)5-8-13(14)15(16)17/h3-9H,1-2H3,(H3,16,17)
InChIKeyGSNWJPNKXPPYME-UHFFFAOYSA-N
XLogP3.38
TPSA59.10 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-(4-fluorophenoxy)-4-methylbenzenecarboximidamide
CID 62308673
2-(4-ethoxyphenoxy)-4-methylbenzenecarboximidamide
CID 62307304
4-methoxy-2-(4-methylphenoxy)benzenecarboximidamide
CID 81302853
4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 81299836
2-methoxy-4-methylbenzenecarboximidamide
CID 62306767
2-[(5-chloro-3-pyridinyl)oxy]-4-methylbenzenecarboximidamide
CID 64601574
4-methyl-2-(3-propan-2-ylphenoxy)benzenecarboximidamide
CID 62308166
2-(3-bromo-5-fluorophenoxy)-4-methylbenzenecarboximidamide
CID 81332379
2-(4-tert-butylphenoxy)-5-methylbenzenecarboximidamide
CID 107930737
2-methyl-4-(5-methyl-2-propan-2-ylphenoxy)benzenecarboximidamide
CID 81269066
2-(3-chloro-4-nitrophenoxy)-4-methylbenzenecarboximidamide
CID 62307325
4-methyl-2-propoxybenzenecarboximidamide;hydrochloride
CID 21250746

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(4-methylphenoxy)benzenecarboximidamide?
The IUPAC name of 4-methyl-2-(4-methylphenoxy)benzenecarboximidamide (CID 62308678) is 4-methyl-2-(4-methylphenoxy)benzenecarboximidamide.
What is the SMILES notation for 4-methyl-2-(4-methylphenoxy)benzenecarboximidamide?
The canonical SMILES for 4-methyl-2-(4-methylphenoxy)benzenecarboximidamide is [H]/N=C(\N)c1ccc(C)cc1Oc1ccc(C)cc1.
What is the InChIKey of 4-methyl-2-(4-methylphenoxy)benzenecarboximidamide?
The InChIKey is GSNWJPNKXPPYME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-10-3-6-12(7-4-10)18-14-9-11(2)5-8-13(14)15(16)17/h3-9H,1-2H3,(H3,16,17).
What are the key properties of 4-methyl-2-(4-methylphenoxy)benzenecarboximidamide?
4-methyl-2-(4-methylphenoxy)benzenecarboximidamide has a molecular weight of 240.31 g/mol, XLogP of 3.38, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(4-methylphenoxy)benzenecarboximidamide is sourced from PubChem (CID 62308678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).