5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one

C13H23N3O2 — CID 81058464

IUPAC5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one
SMILESCC(C)OCCN(C)CCn1cc(N)ccc1=O
InChIInChI=1S/C13H23N3O2/c1-11(2)18-9-8-15(3)6-7-16-10-12(14)4-5-13(16)17/h4-5,10-11H,6-9,14H2,1-3H3
InChIKeyLSLCPODMHHTVGF-UHFFFAOYSA-N
MW253.35 g/mol
LogP0.79
Rot. Bonds7

About 5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one

5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one (PubChem CID 81058464) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one.

Molecular Properties

Compound Name5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one
PubChem CID81058464
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one
SMILESCC(C)OCCN(C)CCn1cc(N)ccc1=O
InChIInChI=1S/C13H23N3O2/c1-11(2)18-9-8-15(3)6-7-16-10-12(14)4-5-13(16)17/h4-5,10-11H,6-9,14H2,1-3H3
InChIKeyLSLCPODMHHTVGF-UHFFFAOYSA-N
XLogP0.79
TPSA60.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-1-[3-(dimethylamino)propyl]pyridin-2-one
CID 43259607
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CID 43574950
5-amino-1-[2-[methyl(2-thiophen-2-ylethyl)amino]ethyl]pyridin-2-one
CID 79476260
5-amino-1-[2-[methyl-[(2-methylfuran-3-yl)methyl]amino]ethyl]pyridin-2-one
CID 61426276
5-amino-1-[2-[methyl-[(4-methyl-1,3-thiazol-5-yl)methyl]amino]ethyl]pyridin-2-one
CID 63841607
5-amino-1-[2-[1-(4-chlorophenyl)ethyl-methylamino]ethyl]pyridin-2-one
CID 62978581
5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one
CID 114948024
2-[2-(5-amino-2-oxo-1-pyridinyl)ethyl-propan-2-ylamino]acetamide
CID 54989117
5-amino-1-[2-[ethyl(propyl)amino]ethyl]pyridin-2-one
CID 43268319
5-amino-1-[2-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]ethyl]pyridin-2-one
CID 79304227
5-amino-1-[2-[methyl-(4-methylcyclohexyl)amino]ethyl]pyridin-2-one
CID 61439168
5-amino-1-(2-propan-2-ylsulfinylethyl)pyridin-2-one
CID 61288873

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one?
The IUPAC name of 5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one (CID 81058464) is 5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one.
What is the SMILES notation for 5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one?
The canonical SMILES for 5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one is CC(C)OCCN(C)CCn1cc(N)ccc1=O.
What is the InChIKey of 5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one?
The InChIKey is LSLCPODMHHTVGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-11(2)18-9-8-15(3)6-7-16-10-12(14)4-5-13(16)17/h4-5,10-11H,6-9,14H2,1-3H3.
What are the key properties of 5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one?
5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one has a molecular weight of 253.35 g/mol, XLogP of 0.79, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-[2-[methyl(2-propan-2-yloxyethyl)amino]ethyl]pyridin-2-one is sourced from PubChem (CID 81058464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).