N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine

C19H23N3 — CID 118102441

IUPACN-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine
SMILESC/N=C(\C)c1cccc(/C(C)=N/c2c(C)cc(C)cc2C)n1
InChIInChI=1S/C19H23N3/c1-12-10-13(2)19(14(3)11-12)21-16(5)18-9-7-8-17(22-18)15(4)20-6/h7-11H,1-6H3/b20-15+,21-16+
InChIKeySIOILTKUDFDDMT-YJKAXRSRSA-N
MW293.41 g/mol
LogP4.59
Rot. Bonds3

About N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine

N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine (PubChem CID 118102441) has the molecular formula C19H23N3 and a molecular weight of 293.41 g/mol. Its IUPAC name is N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine.

Molecular Properties

Compound NameN-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine
PubChem CID118102441
Molecular FormulaC19H23N3
Molecular Weight293.41 g/mol
Exact Mass293.19
IUPAC NameN-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine
SMILESC/N=C(\C)c1cccc(/C(C)=N/c2c(C)cc(C)cc2C)n1
InChIInChI=1S/C19H23N3/c1-12-10-13(2)19(14(3)11-12)21-16(5)18-9-7-8-17(22-18)15(4)20-6/h7-11H,1-6H3/b20-15+,21-16+
InChIKeySIOILTKUDFDDMT-YJKAXRSRSA-N
XLogP4.59
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine?
The IUPAC name of N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine (CID 118102441) is N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine.
What is the SMILES notation for N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine?
The canonical SMILES for N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine is C/N=C(\C)c1cccc(/C(C)=N/c2c(C)cc(C)cc2C)n1.
What is the InChIKey of N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine?
The InChIKey is SIOILTKUDFDDMT-YJKAXRSRSA-N. The full InChI is InChI=1S/C19H23N3/c1-12-10-13(2)19(14(3)11-12)21-16(5)18-9-7-8-17(22-18)15(4)20-6/h7-11H,1-6H3/b20-15+,21-16+.
What are the key properties of N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine?
N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine has a molecular weight of 293.41 g/mol, XLogP of 4.59, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[6-[C-methyl-N-(2,4,6-trimethylphenyl)carbonimidoyl]-2-pyridinyl]ethanimine is sourced from PubChem (CID 118102441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).