N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide

C10H15N3O3 — CID 71807565

IUPACN-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide
SMILESCOc1ncc(NC(=O)C(C)C)c(OC)n1
InChIInChI=1S/C10H15N3O3/c1-6(2)8(14)12-7-5-11-10(16-4)13-9(7)15-3/h5-6H,1-4H3,(H,12,14)
InChIKeySZRRXVMXCZCPMV-UHFFFAOYSA-N
MW225.25 g/mol
LogP1.09
Rot. Bonds4

About N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide

N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide (PubChem CID 71807565) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide
PubChem CID71807565
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC NameN-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide
SMILESCOc1ncc(NC(=O)C(C)C)c(OC)n1
InChIInChI=1S/C10H15N3O3/c1-6(2)8(14)12-7-5-11-10(16-4)13-9(7)15-3/h5-6H,1-4H3,(H,12,14)
InChIKeySZRRXVMXCZCPMV-UHFFFAOYSA-N
XLogP1.09
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide?
The IUPAC name of N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide (CID 71807565) is N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide.
What is the SMILES notation for N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide?
The canonical SMILES for N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide is COc1ncc(NC(=O)C(C)C)c(OC)n1.
What is the InChIKey of N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide?
The InChIKey is SZRRXVMXCZCPMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-6(2)8(14)12-7-5-11-10(16-4)13-9(7)15-3/h5-6H,1-4H3,(H,12,14).
What are the key properties of N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide?
N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide has a molecular weight of 225.25 g/mol, XLogP of 1.09, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxypyrimidin-5-yl)-2-methylpropanamide is sourced from PubChem (CID 71807565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).