2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide

C10H12BrN3O2 — CID 66308557

IUPAC2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide
SMILESCc1ncn(CC(=O)NC2CC2)c(=O)c1Br
InChIInChI=1S/C10H12BrN3O2/c1-6-9(11)10(16)14(5-12-6)4-8(15)13-7-2-3-7/h5,7H,2-4H2,1H3,(H,13,15)
InChIKeyZEQWYVHPJBNQLD-UHFFFAOYSA-N
MW286.13 g/mol
LogP0.59
Rot. Bonds3

About 2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide

2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide (PubChem CID 66308557) has the molecular formula C10H12BrN3O2 and a molecular weight of 286.13 g/mol. Its IUPAC name is 2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide
PubChem CID66308557
Molecular FormulaC10H12BrN3O2
Molecular Weight286.13 g/mol
Exact Mass285.01
IUPAC Name2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide
SMILESCc1ncn(CC(=O)NC2CC2)c(=O)c1Br
InChIInChI=1S/C10H12BrN3O2/c1-6-9(11)10(16)14(5-12-6)4-8(15)13-7-2-3-7/h5,7H,2-4H2,1H3,(H,13,15)
InChIKeyZEQWYVHPJBNQLD-UHFFFAOYSA-N
XLogP0.59
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.13
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide?
The IUPAC name of 2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide (CID 66308557) is 2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide.
What is the SMILES notation for 2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide?
The canonical SMILES for 2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide is Cc1ncn(CC(=O)NC2CC2)c(=O)c1Br.
What is the InChIKey of 2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide?
The InChIKey is ZEQWYVHPJBNQLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrN3O2/c1-6-9(11)10(16)14(5-12-6)4-8(15)13-7-2-3-7/h5,7H,2-4H2,1H3,(H,13,15).
What are the key properties of 2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide?
2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide has a molecular weight of 286.13 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-cyclopropylacetamide is sourced from PubChem (CID 66308557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).