6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine

C13H23N3O3 — CID 103408442

IUPAC6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)cc(OCCCOCCOC)n1
InChIInChI=1S/C13H23N3O3/c1-3-5-12-15-11(14)10-13(16-12)19-7-4-6-18-9-8-17-2/h10H,3-9H2,1-2H3,(H2,14,15,16)
InChIKeyYIYYTNUIDXWJKI-UHFFFAOYSA-N
MW269.34 g/mol
LogP1.44
Rot. Bonds10

About 6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine

6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine (PubChem CID 103408442) has the molecular formula C13H23N3O3 and a molecular weight of 269.34 g/mol. Its IUPAC name is 6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine
PubChem CID103408442
Molecular FormulaC13H23N3O3
Molecular Weight269.34 g/mol
Exact Mass269.17
IUPAC Name6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)cc(OCCCOCCOC)n1
InChIInChI=1S/C13H23N3O3/c1-3-5-12-15-11(14)10-13(16-12)19-7-4-6-18-9-8-17-2/h10H,3-9H2,1-2H3,(H2,14,15,16)
InChIKeyYIYYTNUIDXWJKI-UHFFFAOYSA-N
XLogP1.44
TPSA79.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 51.44
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

6-[3-(2-methoxyethoxy)propoxy]-2-(methoxymethyl)pyrimidin-4-amine
CID 103408444
6-hexoxy-2-propylpyrimidin-4-amine
CID 80949907
[6-[2-(3-methoxypropoxy)ethoxy]-2-propylpyrimidin-4-yl]hydrazine
CID 103176595
4-chloro-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-propylpyrimidine
CID 104561317
6-heptoxy-2-(methoxymethyl)pyrimidin-4-amine
CID 113401616
[2-[3-(2-methoxyethoxy)propoxy]-6-propyl-4-pyridinyl]methanol
CID 103403974
2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine
CID 80949925
6-(2-methoxyethoxy)-N-methyl-2-propylpyrimidin-4-amine
CID 80949765
2-propylpyrimidine-4,6-diamine
CID 67304918
6-(2-propoxyphenoxy)-2-propylpyrimidin-4-amine
CID 80942785
N,2-diethyl-6-[2-(3-methoxypropoxy)ethoxy]pyrimidin-4-amine
CID 103176424
ethane;6-[2-(2-methoxyethoxy)ethoxy]-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143846971

Frequently Asked Questions

What is the IUPAC name of 6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine?
The IUPAC name of 6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine (CID 103408442) is 6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine.
What is the SMILES notation for 6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine?
The canonical SMILES for 6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine is CCCc1nc(N)cc(OCCCOCCOC)n1.
What is the InChIKey of 6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine?
The InChIKey is YIYYTNUIDXWJKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O3/c1-3-5-12-15-11(14)10-13(16-12)19-7-4-6-18-9-8-17-2/h10H,3-9H2,1-2H3,(H2,14,15,16).
What are the key properties of 6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine?
6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine has a molecular weight of 269.34 g/mol, XLogP of 1.44, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine is sourced from PubChem (CID 103408442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).