5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one

C13H15N3O — CID 67311897

IUPAC5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one
SMILESCc1cccc(Nc2[nH]c(=O)ccc2N)c1C
InChIInChI=1S/C13H15N3O/c1-8-4-3-5-11(9(8)2)15-13-10(14)6-7-12(17)16-13/h3-7H,14H2,1-2H3,(H2,15,16,17)
InChIKeyIEIQIDATKOZXHM-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.32
Rot. Bonds2

About 5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one

5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one (PubChem CID 67311897) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one.

Molecular Properties

Compound Name5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one
PubChem CID67311897
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one
SMILESCc1cccc(Nc2[nH]c(=O)ccc2N)c1C
InChIInChI=1S/C13H15N3O/c1-8-4-3-5-11(9(8)2)15-13-10(14)6-7-12(17)16-13/h3-7H,14H2,1-2H3,(H2,15,16,17)
InChIKeyIEIQIDATKOZXHM-UHFFFAOYSA-N
XLogP2.32
TPSA70.91 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one?
The IUPAC name of 5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one (CID 67311897) is 5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one.
What is the SMILES notation for 5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one?
The canonical SMILES for 5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one is Cc1cccc(Nc2[nH]c(=O)ccc2N)c1C.
What is the InChIKey of 5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one?
The InChIKey is IEIQIDATKOZXHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-8-4-3-5-11(9(8)2)15-13-10(14)6-7-12(17)16-13/h3-7H,14H2,1-2H3,(H2,15,16,17).
What are the key properties of 5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one?
5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one has a molecular weight of 229.28 g/mol, XLogP of 2.32, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(2,3-dimethylanilino)-1H-pyridin-2-one is sourced from PubChem (CID 67311897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).