1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one

C10H16N2O2 — CID 107506127

IUPAC1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one
SMILESCOCC(N)Cn1c(C)cccc1=O
InChIInChI=1S/C10H16N2O2/c1-8-4-3-5-10(13)12(8)6-9(11)7-14-2/h3-5,9H,6-7,11H2,1-2H3
InChIKeyUMTRJKBNUURCNW-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.13
Rot. Bonds4

About 1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one

1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one (PubChem CID 107506127) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one.

Molecular Properties

Compound Name1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one
PubChem CID107506127
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one
SMILESCOCC(N)Cn1c(C)cccc1=O
InChIInChI=1S/C10H16N2O2/c1-8-4-3-5-10(13)12(8)6-9(11)7-14-2/h3-5,9H,6-7,11H2,1-2H3
InChIKeyUMTRJKBNUURCNW-UHFFFAOYSA-N
XLogP0.13
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-methoxy-2-(methylamino)propyl]-6-methylpyridin-2-one
CID 107506125
1-(methoxymethyl)-6-methylpyridin-2-one
CID 14787165
1-(3-chloro-2-hydroxypropyl)-6-methylpyridin-2-one
CID 112560173
1-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylpyridin-2-one
CID 103366551
1-[2-amino-2-(oxolan-3-yl)ethyl]-6-methylpyridin-2-one
CID 104747379
1-(2-bromoethyl)-6-methylpyridin-2-one
CID 60876418
1-[2-(4-bromophenoxy)ethyl]-6-methylpyridin-2-one
CID 54970701
methyl 4-[[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]amino]benzoate
CID 75366166
1-[2-(4-iodophenyl)-2-oxoethyl]-6-methylpyridin-2-one
CID 62025283
1-methoxy-3-(2-phenylimidazol-1-yl)propan-2-amine
CID 107506135
ethyl 2,2-dimethyl-4-(2-methyl-6-oxo-1-pyridinyl)-3-oxobutanoate
CID 113369758
1-(2,2-dimethoxyethyl)-6-oxopyridine-2-carboxamide
CID 174969842

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one?
The IUPAC name of 1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one (CID 107506127) is 1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one.
What is the SMILES notation for 1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one?
The canonical SMILES for 1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one is COCC(N)Cn1c(C)cccc1=O.
What is the InChIKey of 1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one?
The InChIKey is UMTRJKBNUURCNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-8-4-3-5-10(13)12(8)6-9(11)7-14-2/h3-5,9H,6-7,11H2,1-2H3.
What are the key properties of 1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one?
1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one has a molecular weight of 196.25 g/mol, XLogP of 0.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-3-methoxypropyl)-6-methylpyridin-2-one is sourced from PubChem (CID 107506127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).