4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine

C14H25N3O3 — CID 103176485

IUPAC4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine
SMILESCCCNc1nc(C)cc(OCCOCCCOC)n1
InChIInChI=1S/C14H25N3O3/c1-4-6-15-14-16-12(2)11-13(17-14)20-10-9-19-8-5-7-18-3/h11H,4-10H2,1-3H3,(H,15,16,17)
InChIKeyAPEFMARZEBZETG-UHFFFAOYSA-N
MW283.37 g/mol
LogP2.04
Rot. Bonds11

About 4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine

4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine (PubChem CID 103176485) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is 4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine.

Molecular Properties

Compound Name4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine
PubChem CID103176485
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Name4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine
SMILESCCCNc1nc(C)cc(OCCOCCCOC)n1
InChIInChI=1S/C14H25N3O3/c1-4-6-15-14-16-12(2)11-13(17-14)20-10-9-19-8-5-7-18-3/h11H,4-10H2,1-3H3,(H,15,16,17)
InChIKeyAPEFMARZEBZETG-UHFFFAOYSA-N
XLogP2.04
TPSA65.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-4-[2-(3-methoxypropoxy)ethoxy]-6-methylpyrimidin-2-amine
CID 103176501
4-(2-methoxyethoxy)-6-methyl-N-propylpyrimidin-2-amine
CID 80858368
N-(3-methoxypropyl)-4-methyl-6-propoxypyrimidin-2-amine
CID 112636619
4-methyl-6-octoxy-N-propylpyrimidin-2-amine
CID 80862007
4-ethoxy-N-(5-methoxypentyl)-6-methylpyrimidin-2-amine
CID 114131177
N-[3-(2-aminoethoxy)propyl]-4-methyl-6-propoxypyrimidin-2-amine
CID 106308368
4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-N,6-dimethylpyrimidin-2-amine
CID 104568171
[4-(3-methoxypropoxy)-6-methylpyrimidin-2-yl]hydrazine
CID 80917412
4-N-[2-(2-methoxyethoxy)ethyl]-6-methyl-2-N-propylpyrimidine-2,4-diamine
CID 80814127
N-hexyl-4-methyl-6-propoxypyrimidin-2-amine
CID 112637799
N'-(2-methoxyethyl)-N'-methyl-N-(4-methyl-6-propoxypyrimidin-2-yl)ethane-1,2-diamine
CID 115974987
6-[2-(3-methoxypropoxy)ethoxy]-N-propylpyrazin-2-amine
CID 103176484

Frequently Asked Questions

What is the IUPAC name of 4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine?
The IUPAC name of 4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine (CID 103176485) is 4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine.
What is the SMILES notation for 4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine?
The canonical SMILES for 4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine is CCCNc1nc(C)cc(OCCOCCCOC)n1.
What is the InChIKey of 4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine?
The InChIKey is APEFMARZEBZETG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-4-6-15-14-16-12(2)11-13(17-14)20-10-9-19-8-5-7-18-3/h11H,4-10H2,1-3H3,(H,15,16,17).
What are the key properties of 4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine?
4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine has a molecular weight of 283.37 g/mol, XLogP of 2.04, 11 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3-methoxypropoxy)ethoxy]-6-methyl-N-propylpyrimidin-2-amine is sourced from PubChem (CID 103176485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).