5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one

C12H17N3O3 — CID 55118344

IUPAC5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one
SMILESCC1COCCN1C(=O)Cn1cc(N)ccc1=O
InChIInChI=1S/C12H17N3O3/c1-9-8-18-5-4-15(9)12(17)7-14-6-10(13)2-3-11(14)16/h2-3,6,9H,4-5,7-8,13H2,1H3
InChIKeyNWIZIRPPWYEOIG-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.32
Rot. Bonds2

About 5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one

5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one (PubChem CID 55118344) has the molecular formula C12H17N3O3 and a molecular weight of 251.29 g/mol. Its IUPAC name is 5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one.

Molecular Properties

Compound Name5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one
PubChem CID55118344
Molecular FormulaC12H17N3O3
Molecular Weight251.29 g/mol
Exact Mass251.13
IUPAC Name5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one
SMILESCC1COCCN1C(=O)Cn1cc(N)ccc1=O
InChIInChI=1S/C12H17N3O3/c1-9-8-18-5-4-15(9)12(17)7-14-6-10(13)2-3-11(14)16/h2-3,6,9H,4-5,7-8,13H2,1H3
InChIKeyNWIZIRPPWYEOIG-UHFFFAOYSA-N
XLogP-0.32
TPSA77.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-methylbutyl)-2-(4-morpholin-4-yl-2-oxo-1-pyridinyl)acetamide
CID 90655131
Ethyl 2-(3-acetamido-2-oxo-1-pyridinyl)acetate
CID 10444200
Ethyl 2-(3-amino-2-oxo-1,2-dihydropyridin-1-yl)acetate
CID 10035571
5-Amino-1-(2-methoxyethyl)-1,2-dihydropyridin-2-one
CID 20117994
Ethyl 2-[2-oxo-3-(propylamino)-1-pyridinyl]acetate
CID 45271635
6-(morpholin-4-ylmethyl)-1H-pyridin-2-one
CID 144126224
N-(1-morpholin-4-ylpropan-2-yl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 47035953
N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-6-oxo-1H-pyridine-2-carboxamide
CID 132360567
3-Amino-5-fluoro-1-(2-morpholin-4-ylethyl)pyridin-2-one
CID 130269256
4-Fluoro-1-(2-methoxyethyl)-3-piperazin-1-ylpyridin-2-one
CID 178099399
5-Fluoro-1-(2-methoxyethyl)-3-piperazin-1-ylpyridin-2-one
CID 178099415
5-morpholin-4-yl-1H-pyridin-2-one
CID 101721680

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one?
The IUPAC name of 5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one (CID 55118344) is 5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one.
What is the SMILES notation for 5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one?
The canonical SMILES for 5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one is CC1COCCN1C(=O)Cn1cc(N)ccc1=O.
What is the InChIKey of 5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one?
The InChIKey is NWIZIRPPWYEOIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O3/c1-9-8-18-5-4-15(9)12(17)7-14-6-10(13)2-3-11(14)16/h2-3,6,9H,4-5,7-8,13H2,1H3.
What are the key properties of 5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one?
5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one has a molecular weight of 251.29 g/mol, XLogP of -0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-[2-(3-methylmorpholin-4-yl)-2-oxoethyl]pyridin-2-one is sourced from PubChem (CID 55118344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).