1-(2-aminopropyl)-4-methylpyridin-2-one

C9H14N2O — CID 62962673

IUPAC1-(2-aminopropyl)-4-methylpyridin-2-one
SMILESCc1ccn(CC(C)N)c(=O)c1
InChIInChI=1S/C9H14N2O/c1-7-3-4-11(6-8(2)10)9(12)5-7/h3-5,8H,6,10H2,1-2H3
InChIKeyVELUQHVOLOAXTK-UHFFFAOYSA-N
MW166.22 g/mol
LogP0.50
Rot. Bonds2

About 1-(2-aminopropyl)-4-methylpyridin-2-one

1-(2-aminopropyl)-4-methylpyridin-2-one (PubChem CID 62962673) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 1-(2-aminopropyl)-4-methylpyridin-2-one.

Molecular Properties

Compound Name1-(2-aminopropyl)-4-methylpyridin-2-one
PubChem CID62962673
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name1-(2-aminopropyl)-4-methylpyridin-2-one
SMILESCc1ccn(CC(C)N)c(=O)c1
InChIInChI=1S/C9H14N2O/c1-7-3-4-11(6-8(2)10)9(12)5-7/h3-5,8H,6,10H2,1-2H3
InChIKeyVELUQHVOLOAXTK-UHFFFAOYSA-N
XLogP0.50
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-amino-2-hydroxypropyl)-4-methylpyridin-2-one
CID 62962681
3,3,3-trifluoro-2-[(4-methyl-2-oxo-1-pyridinyl)methyl]propanethioamide
CID 103368934
1-[2-hydroxy-3-(methylamino)propyl]-4-methylpyridin-2-one
CID 62962682
1-(2-hydroxy-2-phenylethyl)-4-methylpyridin-2-one
CID 55153499
methyl 2-acetamido-3-(4-methyl-2-oxo-1-pyridinyl)propanoate
CID 65441441
4-(2-aminopropyl)-1-(2-methylpropyl)pyridin-2-one
CID 105462256
1-(2-cyclopentyl-2-hydroxyethyl)-4-methylpyridin-2-one
CID 104753235
1-[(4-aminophenyl)methyl]-4-methylpyridin-2-one
CID 62962113
1-[2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-4-methylpyridin-2-one
CID 62962661
4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one
CID 62962145
4-methyl-1-(2-methylsulfanylethyl)pyridin-2-one
CID 115900483
1-(2-hydroxy-2-naphthalen-2-ylethyl)-4-methylpyridin-2-one
CID 62963596

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminopropyl)-4-methylpyridin-2-one?
The IUPAC name of 1-(2-aminopropyl)-4-methylpyridin-2-one (CID 62962673) is 1-(2-aminopropyl)-4-methylpyridin-2-one.
What is the SMILES notation for 1-(2-aminopropyl)-4-methylpyridin-2-one?
The canonical SMILES for 1-(2-aminopropyl)-4-methylpyridin-2-one is Cc1ccn(CC(C)N)c(=O)c1.
What is the InChIKey of 1-(2-aminopropyl)-4-methylpyridin-2-one?
The InChIKey is VELUQHVOLOAXTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-7-3-4-11(6-8(2)10)9(12)5-7/h3-5,8H,6,10H2,1-2H3.
What are the key properties of 1-(2-aminopropyl)-4-methylpyridin-2-one?
1-(2-aminopropyl)-4-methylpyridin-2-one has a molecular weight of 166.22 g/mol, XLogP of 0.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminopropyl)-4-methylpyridin-2-one is sourced from PubChem (CID 62962673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).