N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide

C12H18N2O3 — CID 65110653

IUPACN-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide
SMILESCC(C)(O)CNC(=O)CCn1ccccc1=O
InChIInChI=1S/C12H18N2O3/c1-12(2,17)9-13-10(15)6-8-14-7-4-3-5-11(14)16/h3-5,7,17H,6,8-9H2,1-2H3,(H,13,15)
InChIKeyWRYRIRDJZVGXJD-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.13
Rot. Bonds5

About N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide

N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide (PubChem CID 65110653) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide
PubChem CID65110653
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC NameN-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide
SMILESCC(C)(O)CNC(=O)CCn1ccccc1=O
InChIInChI=1S/C12H18N2O3/c1-12(2,17)9-13-10(15)6-8-14-7-4-3-5-11(14)16/h3-5,7,17H,6,8-9H2,1-2H3,(H,13,15)
InChIKeyWRYRIRDJZVGXJD-UHFFFAOYSA-N
XLogP0.13
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide?
The IUPAC name of N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide (CID 65110653) is N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide.
What is the SMILES notation for N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide?
The canonical SMILES for N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide is CC(C)(O)CNC(=O)CCn1ccccc1=O.
What is the InChIKey of N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide?
The InChIKey is WRYRIRDJZVGXJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-12(2,17)9-13-10(15)6-8-14-7-4-3-5-11(14)16/h3-5,7,17H,6,8-9H2,1-2H3,(H,13,15).
What are the key properties of N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide?
N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide has a molecular weight of 238.29 g/mol, XLogP of 0.13, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylpropyl)-3-(2-oxo-1-pyridinyl)propanamide is sourced from PubChem (CID 65110653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).