3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one

C17H22N2O2 — CID 82517946

IUPAC3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one
SMILESCCOc1ccc(-c2ccc(C(C)(C)N)c(=O)n2C)cc1
InChIInChI=1S/C17H22N2O2/c1-5-21-13-8-6-12(7-9-13)15-11-10-14(17(2,3)18)16(20)19(15)4/h6-11H,5,18H2,1-4H3
InChIKeyVYGFFLDRTQYHHY-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.64
Rot. Bonds4

About 3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one

3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one (PubChem CID 82517946) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one.

Molecular Properties

Compound Name3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one
PubChem CID82517946
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one
SMILESCCOc1ccc(-c2ccc(C(C)(C)N)c(=O)n2C)cc1
InChIInChI=1S/C17H22N2O2/c1-5-21-13-8-6-12(7-9-13)15-11-10-14(17(2,3)18)16(20)19(15)4/h6-11H,5,18H2,1-4H3
InChIKeyVYGFFLDRTQYHHY-UHFFFAOYSA-N
XLogP2.64
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(4-ethoxyphenyl)-1,3-dimethylpyridin-2-one
CID 149000384
3-(chloromethyl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one
CID 82517951
2-[6-(4-ethoxyphenyl)-1-methyl-2-oxo-3-pyridinyl]acetonitrile
CID 82517950
6-(4-ethoxyphenyl)-1-methyl-3-[(propan-2-ylamino)methyl]pyridin-2-one
CID 82517956
3-(2-aminopropan-2-yl)-6-(5-chloro-2-methoxyphenyl)-1-methylpyridin-2-one
CID 82517234
3-(1-aminoethyl)-6-(4-ethoxyphenyl)-1-propan-2-ylpyridin-2-one
CID 82517914
3-(aminomethyl)-1-methyl-6-[4-(2-methylpropoxy)phenyl]pyridin-2-one
CID 82189512
3-amino-6-(4-ethoxyphenyl)-1-(2-methylpropyl)pyridin-2-one
CID 82467100
3-(aminomethyl)-6-(4-ethoxyphenyl)-1-ethyl-4-methylpyridin-2-one
CID 82189704
3-(2-hydroxypropan-2-yl)-6-(4-methoxyphenyl)-1-propylpyridin-2-one
CID 82518062
6-(4-ethoxyphenyl)-2-oxo-1-propan-2-ylpyridine-3-carboximidamide
CID 82517919
2-[6-(4-ethoxyphenyl)-1-ethyl-2-oxo-3-pyridinyl]acetic acid
CID 82517930

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one?
The IUPAC name of 3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one (CID 82517946) is 3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one.
What is the SMILES notation for 3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one?
The canonical SMILES for 3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one is CCOc1ccc(-c2ccc(C(C)(C)N)c(=O)n2C)cc1.
What is the InChIKey of 3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one?
The InChIKey is VYGFFLDRTQYHHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-5-21-13-8-6-12(7-9-13)15-11-10-14(17(2,3)18)16(20)19(15)4/h6-11H,5,18H2,1-4H3.
What are the key properties of 3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one?
3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one has a molecular weight of 286.38 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminopropan-2-yl)-6-(4-ethoxyphenyl)-1-methylpyridin-2-one is sourced from PubChem (CID 82517946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).