5-amino-1-benzylpyridin-2-one

C12H12N2O — CID 11593634

IUPAC5-amino-1-benzylpyridin-2-one
SMILESNc1ccc(=O)n(Cc2ccccc2)c1
InChIInChI=1S/C12H12N2O/c13-11-6-7-12(15)14(9-11)8-10-4-2-1-3-5-10/h1-7,9H,8,13H2
InChIKeyUFDYREYQWRJCHY-UHFFFAOYSA-N
MW200.24 g/mol
LogP1.48
Rot. Bonds2

About 5-amino-1-benzylpyridin-2-one

5-amino-1-benzylpyridin-2-one (PubChem CID 11593634) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 5-amino-1-benzylpyridin-2-one.

Molecular Properties

Compound Name5-amino-1-benzylpyridin-2-one
PubChem CID11593634
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name5-amino-1-benzylpyridin-2-one
SMILESNc1ccc(=O)n(Cc2ccccc2)c1
InChIInChI=1S/C12H12N2O/c13-11-6-7-12(15)14(9-11)8-10-4-2-1-3-5-10/h1-7,9H,8,13H2
InChIKeyUFDYREYQWRJCHY-UHFFFAOYSA-N
XLogP1.48
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1-benzylpyridin-2-one?
The IUPAC name of 5-amino-1-benzylpyridin-2-one (CID 11593634) is 5-amino-1-benzylpyridin-2-one.
What is the SMILES notation for 5-amino-1-benzylpyridin-2-one?
The canonical SMILES for 5-amino-1-benzylpyridin-2-one is Nc1ccc(=O)n(Cc2ccccc2)c1.
What is the InChIKey of 5-amino-1-benzylpyridin-2-one?
The InChIKey is UFDYREYQWRJCHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c13-11-6-7-12(15)14(9-11)8-10-4-2-1-3-5-10/h1-7,9H,8,13H2.
What are the key properties of 5-amino-1-benzylpyridin-2-one?
5-amino-1-benzylpyridin-2-one has a molecular weight of 200.24 g/mol, XLogP of 1.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-benzylpyridin-2-one is sourced from PubChem (CID 11593634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).