3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one

C13H14N2O2 — CID 105487975

IUPAC3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one
SMILESCCn1c(-c2cccc(O)c2)ccc(N)c1=O
InChIInChI=1S/C13H14N2O2/c1-2-15-12(7-6-11(14)13(15)17)9-4-3-5-10(16)8-9/h3-8,16H,2,14H2,1H3
InChIKeyDTSOVLPGMFCZLV-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.82
Rot. Bonds2

About 3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one

3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one (PubChem CID 105487975) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one
PubChem CID105487975
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one
SMILESCCn1c(-c2cccc(O)c2)ccc(N)c1=O
InChIInChI=1S/C13H14N2O2/c1-2-15-12(7-6-11(14)13(15)17)9-4-3-5-10(16)8-9/h3-8,16H,2,14H2,1H3
InChIKeyDTSOVLPGMFCZLV-UHFFFAOYSA-N
XLogP1.82
TPSA68.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one?
The IUPAC name of 3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one (CID 105487975) is 3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one.
What is the SMILES notation for 3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one?
The canonical SMILES for 3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one is CCn1c(-c2cccc(O)c2)ccc(N)c1=O.
What is the InChIKey of 3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one?
The InChIKey is DTSOVLPGMFCZLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-2-15-12(7-6-11(14)13(15)17)9-4-3-5-10(16)8-9/h3-8,16H,2,14H2,1H3.
What are the key properties of 3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one?
3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one has a molecular weight of 230.27 g/mol, XLogP of 1.82, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-ethyl-6-(3-hydroxyphenyl)pyridin-2-one is sourced from PubChem (CID 105487975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).