2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide

C14H24N4O2 — CID 136713555

IUPAC2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)NC(C)c1c(C)nc(C)[nH]c1=O
InChIInChI=1S/C14H24N4O2/c1-7-18(6)14(20)10(4)15-8(2)12-9(3)16-11(5)17-13(12)19/h8,10,15H,7H2,1-6H3,(H,16,17,19)
InChIKeyIXPQMBCIJQNCDX-UHFFFAOYSA-N
MW280.37 g/mol
LogP0.90
Rot. Bonds5

About 2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide

2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide (PubChem CID 136713555) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide.

Molecular Properties

Compound Name2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide
PubChem CID136713555
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)NC(C)c1c(C)nc(C)[nH]c1=O
InChIInChI=1S/C14H24N4O2/c1-7-18(6)14(20)10(4)15-8(2)12-9(3)16-11(5)17-13(12)19/h8,10,15H,7H2,1-6H3,(H,16,17,19)
InChIKeyIXPQMBCIJQNCDX-UHFFFAOYSA-N
XLogP0.90
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide 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-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide?
The IUPAC name of 2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide (CID 136713555) is 2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide.
What is the SMILES notation for 2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide?
The canonical SMILES for 2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide is CCN(C)C(=O)C(C)NC(C)c1c(C)nc(C)[nH]c1=O.
What is the InChIKey of 2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide?
The InChIKey is IXPQMBCIJQNCDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-7-18(6)14(20)10(4)15-8(2)12-9(3)16-11(5)17-13(12)19/h8,10,15H,7H2,1-6H3,(H,16,17,19).
What are the key properties of 2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide?
2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide has a molecular weight of 280.37 g/mol, XLogP of 0.90, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide is sourced from PubChem (CID 136713555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).