3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one

C12H10N2O2 — CID 136711080

IUPAC3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one
SMILESO=c1[nH]cccc1/N=C/c1ccccc1O
InChIInChI=1S/C12H10N2O2/c15-11-6-2-1-4-9(11)8-14-10-5-3-7-13-12(10)16/h1-8,15H,(H,13,16)/b14-8+
InChIKeyOTKNLCUEPBURRK-RIYZIHGNSA-N
MW214.22 g/mol
LogP1.83
Rot. Bonds2

About 3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one

3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one (PubChem CID 136711080) has the molecular formula C12H10N2O2 and a molecular weight of 214.22 g/mol. Its IUPAC name is 3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one.

Molecular Properties

Compound Name3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one
PubChem CID136711080
Molecular FormulaC12H10N2O2
Molecular Weight214.22 g/mol
Exact Mass214.07
IUPAC Name3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one
SMILESO=c1[nH]cccc1/N=C/c1ccccc1O
InChIInChI=1S/C12H10N2O2/c15-11-6-2-1-4-9(11)8-14-10-5-3-7-13-12(10)16/h1-8,15H,(H,13,16)/b14-8+
InChIKeyOTKNLCUEPBURRK-RIYZIHGNSA-N
XLogP1.83
TPSA65.45 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 51.83
H-Bond Donors ≤ 52
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 3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one?
The IUPAC name of 3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one (CID 136711080) is 3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one.
What is the SMILES notation for 3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one?
The canonical SMILES for 3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one is O=c1[nH]cccc1/N=C/c1ccccc1O.
What is the InChIKey of 3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one?
The InChIKey is OTKNLCUEPBURRK-RIYZIHGNSA-N. The full InChI is InChI=1S/C12H10N2O2/c15-11-6-2-1-4-9(11)8-14-10-5-3-7-13-12(10)16/h1-8,15H,(H,13,16)/b14-8+.
What are the key properties of 3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one?
3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one has a molecular weight of 214.22 g/mol, XLogP of 1.83, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-hydroxyphenyl)methylideneamino]-1H-pyridin-2-one is sourced from PubChem (CID 136711080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).