1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one

C14H14N2O2 — CID 703664

IUPAC1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one
SMILESCc1cc(C)n(N=Cc2ccccc2O)c(=O)c1
InChIInChI=1S/C14H14N2O2/c1-10-7-11(2)16(14(18)8-10)15-9-12-5-3-4-6-13(12)17/h3-9,17H,1-2H3
InChIKeyCGHXCBAQQRNWJI-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.05
Rot. Bonds2

About 1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one

1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one (PubChem CID 703664) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one.

Molecular Properties

Compound Name1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one
PubChem CID703664
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one
SMILESCc1cc(C)n(N=Cc2ccccc2O)c(=O)c1
InChIInChI=1S/C14H14N2O2/c1-10-7-11(2)16(14(18)8-10)15-9-12-5-3-4-6-13(12)17/h3-9,17H,1-2H3
InChIKeyCGHXCBAQQRNWJI-UHFFFAOYSA-N
XLogP2.05
TPSA54.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one?
The IUPAC name of 1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one (CID 703664) is 1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one.
What is the SMILES notation for 1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one?
The canonical SMILES for 1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one is Cc1cc(C)n(N=Cc2ccccc2O)c(=O)c1.
What is the InChIKey of 1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one?
The InChIKey is CGHXCBAQQRNWJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-10-7-11(2)16(14(18)8-10)15-9-12-5-3-4-6-13(12)17/h3-9,17H,1-2H3.
What are the key properties of 1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one?
1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one has a molecular weight of 242.28 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-hydroxyphenyl)methylideneamino]-4,6-dimethylpyridin-2-one is sourced from PubChem (CID 703664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).