2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine

C10H16N2O4 — CID 57401299

IUPAC2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine
SMILESCOCOCCc1cnc(OC)nc1OC
InChIInChI=1S/C10H16N2O4/c1-13-7-16-5-4-8-6-11-10(15-3)12-9(8)14-2/h6H,4-5,7H2,1-3H3
InChIKeyWSNVKOBRGWHIDJ-UHFFFAOYSA-N
MW228.25 g/mol
LogP0.66
Rot. Bonds7

About 2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine

2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine (PubChem CID 57401299) has the molecular formula C10H16N2O4 and a molecular weight of 228.25 g/mol. Its IUPAC name is 2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine.

Molecular Properties

Compound Name2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine
PubChem CID57401299
Molecular FormulaC10H16N2O4
Molecular Weight228.25 g/mol
Exact Mass228.11
IUPAC Name2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine
SMILESCOCOCCc1cnc(OC)nc1OC
InChIInChI=1S/C10H16N2O4/c1-13-7-16-5-4-8-6-11-10(15-3)12-9(8)14-2/h6H,4-5,7H2,1-3H3
InChIKeyWSNVKOBRGWHIDJ-UHFFFAOYSA-N
XLogP0.66
TPSA62.70 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine?
The IUPAC name of 2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine (CID 57401299) is 2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine.
What is the SMILES notation for 2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine?
The canonical SMILES for 2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine is COCOCCc1cnc(OC)nc1OC.
What is the InChIKey of 2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine?
The InChIKey is WSNVKOBRGWHIDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O4/c1-13-7-16-5-4-8-6-11-10(15-3)12-9(8)14-2/h6H,4-5,7H2,1-3H3.
What are the key properties of 2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine?
2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine has a molecular weight of 228.25 g/mol, XLogP of 0.66, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine is sourced from PubChem (CID 57401299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).