2-methoxy-4-methylbenzenecarboximidamide

C9H12N2O — CID 62306767

IUPAC2-methoxy-4-methylbenzenecarboximidamide
SMILES[H]/N=C(\N)c1ccc(C)cc1OC
InChIInChI=1S/C9H12N2O/c1-6-3-4-7(9(10)11)8(5-6)12-2/h3-5H,1-2H3,(H3,10,11)
InChIKeyOSKLPLMHCPGBRG-UHFFFAOYSA-N
MW164.21 g/mol
LogP1.29
Rot. Bonds2

About 2-methoxy-4-methylbenzenecarboximidamide

2-methoxy-4-methylbenzenecarboximidamide (PubChem CID 62306767) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 2-methoxy-4-methylbenzenecarboximidamide.

Molecular Properties

Compound Name2-methoxy-4-methylbenzenecarboximidamide
PubChem CID62306767
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name2-methoxy-4-methylbenzenecarboximidamide
SMILES[H]/N=C(\N)c1ccc(C)cc1OC
InChIInChI=1S/C9H12N2O/c1-6-3-4-7(9(10)11)8(5-6)12-2/h3-5H,1-2H3,(H3,10,11)
InChIKeyOSKLPLMHCPGBRG-UHFFFAOYSA-N
XLogP1.29
TPSA59.10 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.29
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

4-methoxy-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 81299836
2,4-dimethoxybenzenecarboximidamide
CID 4138242
4-chloro-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 63093366
4-bromo-2-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 114904752
4-methyl-2-(4-methylphenoxy)benzenecarboximidamide
CID 62308678
4-chloro-2-methoxybenzenecarboximidamide
CID 63093709
4-[(2,4-dimethylphenoxy)methyl]-2-methoxybenzenecarboximidamide
CID 106791193
4-methyl-2-propoxybenzenecarboximidamide;hydrochloride
CID 21250746
2-cyclopentyloxy-4-methylbenzenecarboximidamide
CID 62308845
4-methoxy-2-(4-methylphenoxy)benzenecarboximidamide
CID 81302853
2-[2-(2-methoxyethoxy)ethoxy]-4-methylbenzenecarboximidamide
CID 113426988
2-bromo-3-fluoro-4-(2-methoxy-4-methylphenoxy)benzenecarboximidamide
CID 107536673

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-methylbenzenecarboximidamide?
The IUPAC name of 2-methoxy-4-methylbenzenecarboximidamide (CID 62306767) is 2-methoxy-4-methylbenzenecarboximidamide.
What is the SMILES notation for 2-methoxy-4-methylbenzenecarboximidamide?
The canonical SMILES for 2-methoxy-4-methylbenzenecarboximidamide is [H]/N=C(\N)c1ccc(C)cc1OC.
What is the InChIKey of 2-methoxy-4-methylbenzenecarboximidamide?
The InChIKey is OSKLPLMHCPGBRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-6-3-4-7(9(10)11)8(5-6)12-2/h3-5H,1-2H3,(H3,10,11).
What are the key properties of 2-methoxy-4-methylbenzenecarboximidamide?
2-methoxy-4-methylbenzenecarboximidamide has a molecular weight of 164.21 g/mol, XLogP of 1.29, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-methylbenzenecarboximidamide is sourced from PubChem (CID 62306767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).