5-ethyl-2-methoxypyrimidine

C7H10N2O — CID 20754775

IUPAC5-ethyl-2-methoxypyrimidine
SMILESCCc1cnc(OC)nc1
InChIInChI=1S/C7H10N2O/c1-3-6-4-8-7(10-2)9-5-6/h4-5H,3H2,1-2H3
InChIKeyDBASJPDGFMOOBG-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.05
Rot. Bonds2

About 5-ethyl-2-methoxypyrimidine

5-ethyl-2-methoxypyrimidine (PubChem CID 20754775) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 5-ethyl-2-methoxypyrimidine.

Molecular Properties

Compound Name5-ethyl-2-methoxypyrimidine
PubChem CID20754775
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name5-ethyl-2-methoxypyrimidine
SMILESCCc1cnc(OC)nc1
InChIInChI=1S/C7H10N2O/c1-3-6-4-8-7(10-2)9-5-6/h4-5H,3H2,1-2H3
InChIKeyDBASJPDGFMOOBG-UHFFFAOYSA-N
XLogP1.05
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methoxypyrimidine?
The IUPAC name of 5-ethyl-2-methoxypyrimidine (CID 20754775) is 5-ethyl-2-methoxypyrimidine.
What is the SMILES notation for 5-ethyl-2-methoxypyrimidine?
The canonical SMILES for 5-ethyl-2-methoxypyrimidine is CCc1cnc(OC)nc1.
What is the InChIKey of 5-ethyl-2-methoxypyrimidine?
The InChIKey is DBASJPDGFMOOBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-3-6-4-8-7(10-2)9-5-6/h4-5H,3H2,1-2H3.
What are the key properties of 5-ethyl-2-methoxypyrimidine?
5-ethyl-2-methoxypyrimidine has a molecular weight of 138.17 g/mol, XLogP of 1.05, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methoxypyrimidine is sourced from PubChem (CID 20754775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).