4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine

C10H16N2O2 — CID 13091091

IUPAC4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine
SMILESCCOCc1nc(C)cc(OCC)n1
InChIInChI=1S/C10H16N2O2/c1-4-13-7-9-11-8(3)6-10(12-9)14-5-2/h6H,4-5,7H2,1-3H3
InChIKeyMNVMWWCAVUEBDT-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.72
Rot. Bonds5

About 4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine

4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine (PubChem CID 13091091) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine.

Molecular Properties

Compound Name4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine
PubChem CID13091091
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine
SMILESCCOCc1nc(C)cc(OCC)n1
InChIInChI=1S/C10H16N2O2/c1-4-13-7-9-11-8(3)6-10(12-9)14-5-2/h6H,4-5,7H2,1-3H3
InChIKeyMNVMWWCAVUEBDT-UHFFFAOYSA-N
XLogP1.72
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine?
The IUPAC name of 4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine (CID 13091091) is 4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine.
What is the SMILES notation for 4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine?
The canonical SMILES for 4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine is CCOCc1nc(C)cc(OCC)n1.
What is the InChIKey of 4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine?
The InChIKey is MNVMWWCAVUEBDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-4-13-7-9-11-8(3)6-10(12-9)14-5-2/h6H,4-5,7H2,1-3H3.
What are the key properties of 4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine?
4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine has a molecular weight of 196.25 g/mol, XLogP of 1.72, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-2-(ethoxymethyl)-6-methylpyrimidine is sourced from PubChem (CID 13091091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).