N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide

C18H20N2O — CID 4779367

IUPACN-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide
SMILESCC(=O)N(/C(C)=N/c1ccc(C)cc1)c1ccc(C)cc1
InChIInChI=1S/C18H20N2O/c1-13-5-9-17(10-6-13)19-15(3)20(16(4)21)18-11-7-14(2)8-12-18/h5-12H,1-4H3/b19-15+
InChIKeyRYFOISPFRDTZSH-XDJHFCHBSA-N
MW280.37 g/mol
LogP4.41
Rot. Bonds2

About N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide

N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide (PubChem CID 4779367) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide
PubChem CID4779367
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide
SMILESCC(=O)N(/C(C)=N/c1ccc(C)cc1)c1ccc(C)cc1
InChIInChI=1S/C18H20N2O/c1-13-5-9-17(10-6-13)19-15(3)20(16(4)21)18-11-7-14(2)8-12-18/h5-12H,1-4H3/b19-15+
InChIKeyRYFOISPFRDTZSH-XDJHFCHBSA-N
XLogP4.41
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 54.41
H-Bond Donors ≤ 50
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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Frequently Asked Questions

What is the IUPAC name of N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide?
The IUPAC name of N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide (CID 4779367) is N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide?
The canonical SMILES for N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide is CC(=O)N(/C(C)=N/c1ccc(C)cc1)c1ccc(C)cc1.
What is the InChIKey of N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide?
The InChIKey is RYFOISPFRDTZSH-XDJHFCHBSA-N. The full InChI is InChI=1S/C18H20N2O/c1-13-5-9-17(10-6-13)19-15(3)20(16(4)21)18-11-7-14(2)8-12-18/h5-12H,1-4H3/b19-15+.
What are the key properties of N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide?
N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide has a molecular weight of 280.37 g/mol, XLogP of 4.41, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 4779367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).