3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one

C9H14N2O2 — CID 165473707

IUPAC3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one
SMILESCC(C)(O)Cn1cccc(N)c1=O
InChIInChI=1S/C9H14N2O2/c1-9(2,13)6-11-5-3-4-7(10)8(11)12/h3-5,13H,6,10H2,1-2H3
InChIKeyJQWYNRRMNFMMFE-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.20
Rot. Bonds2

About 3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one

3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one (PubChem CID 165473707) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one
PubChem CID165473707
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one
SMILESCC(C)(O)Cn1cccc(N)c1=O
InChIInChI=1S/C9H14N2O2/c1-9(2,13)6-11-5-3-4-7(10)8(11)12/h3-5,13H,6,10H2,1-2H3
InChIKeyJQWYNRRMNFMMFE-UHFFFAOYSA-N
XLogP0.20
TPSA68.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 168932531
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3-amino-1-pentylpyridin-2-one
CID 62102446
2-(3-amino-2-oxo-1-pyridinyl)-N-ethylacetamide
CID 62101961
ethyl 2-[2-(3-amino-2-oxo-1-pyridinyl)ethoxy]acetate
CID 138585490
2-(3-amino-2-oxo-1-pyridinyl)-N-pentan-3-ylacetamide
CID 62102777
3-amino-1-[(4-propan-2-ylphenyl)methyl]pyridin-2-one
CID 55035658
3-amino-1-[(4-iodophenyl)methyl]pyridin-2-one
CID 65478210
3-amino-1-[(2,6-difluorophenyl)methyl]pyridin-2-one
CID 114930175
2-(3-amino-2-oxo-1-pyridinyl)-N-(2-methylpropyl)acetamide
CID 62101797
3-amino-1-[2-(2-methylimidazol-1-yl)ethyl]pyridin-2-one
CID 62101802
3-amino-1-[(2-bromophenyl)methyl]pyridin-2-one
CID 62102931

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one?
The IUPAC name of 3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one (CID 165473707) is 3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one.
What is the SMILES notation for 3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one?
The canonical SMILES for 3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one is CC(C)(O)Cn1cccc(N)c1=O.
What is the InChIKey of 3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one?
The InChIKey is JQWYNRRMNFMMFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-9(2,13)6-11-5-3-4-7(10)8(11)12/h3-5,13H,6,10H2,1-2H3.
What are the key properties of 3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one?
3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one has a molecular weight of 182.22 g/mol, XLogP of 0.20, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(2-hydroxy-2-methylpropyl)pyridin-2-one is sourced from PubChem (CID 165473707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).