3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one

C10H16N2O — CID 22093028

IUPAC3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one
SMILESCCn1c(C)c(C)c(C)c(N)c1=O
InChIInChI=1S/C10H16N2O/c1-5-12-8(4)6(2)7(3)9(11)10(12)13/h5,11H2,1-4H3
InChIKeyZCANYIFPDXHNAN-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.38
Rot. Bonds1

About 3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one

3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one (PubChem CID 22093028) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one.

Molecular Properties

Compound Name3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one
PubChem CID22093028
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one
SMILESCCn1c(C)c(C)c(C)c(N)c1=O
InChIInChI=1S/C10H16N2O/c1-5-12-8(4)6(2)7(3)9(11)10(12)13/h5,11H2,1-4H3
InChIKeyZCANYIFPDXHNAN-UHFFFAOYSA-N
XLogP1.38
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-hydroxy-5-isocyano-3,4-dimethyl-6-oxo-1-pyridinyl)ethyl]acetamide
CID 20801700
1-Ethyl-3,4,5,6-tetramethylpyridin-2-one
CID 22093020
3-Amino-1-butyl-5,6-dimethyl-2-pyridone
CID 22266463
3-Amino-1,4,5,6-tetramethylpyridin-2-one
CID 23382240
3-Isocyanato-1,4,5,6-tetramethylpyridin-2-one
CID 23382241
methyl N-(1,4,5,6-tetramethyl-2-oxo-3-pyridinyl)carbamate
CID 23382244
2-[2,3-dimethyl-5-(methylamino)-6-oxo-1-pyridinyl]-N-methylacetamide
CID 23403529
1-Ethyl-3-isocyano-5,6-dimethylpyridin-2-one
CID 23587855
3-Amino-1,5,6-trimethylpyridin-2-one
CID 23587878
3-Amino-1,4,6-trimethylpyridin-2-one
CID 54015393
1-Ethyl-6-hydroxy-3-isocyano-4,5-dimethylpyridin-2-one
CID 59676324
(4,6-Dimethyl-2-oxo-1-propan-2-yl-3-pyridinyl)azanide;tungsten
CID 59885533

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one?
The IUPAC name of 3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one (CID 22093028) is 3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one.
What is the SMILES notation for 3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one?
The canonical SMILES for 3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one is CCn1c(C)c(C)c(C)c(N)c1=O.
What is the InChIKey of 3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one?
The InChIKey is ZCANYIFPDXHNAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-5-12-8(4)6(2)7(3)9(11)10(12)13/h5,11H2,1-4H3.
What are the key properties of 3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one?
3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one has a molecular weight of 180.25 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-ethyl-4,5,6-trimethylpyridin-2-one is sourced from PubChem (CID 22093028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).