2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide

C11H17N3O2 — CID 22952698

IUPAC2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide
SMILESCC(C)C(=O)Nc1ccn(C(C)C)c(=O)n1
InChIInChI=1S/C11H17N3O2/c1-7(2)10(15)12-9-5-6-14(8(3)4)11(16)13-9/h5-8H,1-4H3,(H,12,13,15,16)
InChIKeyURAURTLBEOXILS-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.42
Rot. Bonds3

About 2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide

2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide (PubChem CID 22952698) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide
PubChem CID22952698
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide
SMILESCC(C)C(=O)Nc1ccn(C(C)C)c(=O)n1
InChIInChI=1S/C11H17N3O2/c1-7(2)10(15)12-9-5-6-14(8(3)4)11(16)13-9/h5-8H,1-4H3,(H,12,13,15,16)
InChIKeyURAURTLBEOXILS-UHFFFAOYSA-N
XLogP1.42
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide?
The IUPAC name of 2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide (CID 22952698) is 2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide?
The canonical SMILES for 2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide is CC(C)C(=O)Nc1ccn(C(C)C)c(=O)n1.
What is the InChIKey of 2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide?
The InChIKey is URAURTLBEOXILS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-7(2)10(15)12-9-5-6-14(8(3)4)11(16)13-9/h5-8H,1-4H3,(H,12,13,15,16).
What are the key properties of 2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide?
2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide has a molecular weight of 223.28 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-oxo-1-propan-2-ylpyrimidin-4-yl)propanamide is sourced from PubChem (CID 22952698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).