2-(ethoxymethyl)pyrimidine

C7H10N2O — CID 89045455

IUPAC2-(ethoxymethyl)pyrimidine
SMILESCCOCc1ncccn1
InChIInChI=1S/C7H10N2O/c1-2-10-6-7-8-4-3-5-9-7/h3-5H,2,6H2,1H3
InChIKeyBIMRLBCIRDTAMM-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.01
Rot. Bonds3

About 2-(ethoxymethyl)pyrimidine

2-(ethoxymethyl)pyrimidine (PubChem CID 89045455) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-(ethoxymethyl)pyrimidine.

Molecular Properties

Compound Name2-(ethoxymethyl)pyrimidine
PubChem CID89045455
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name2-(ethoxymethyl)pyrimidine
SMILESCCOCc1ncccn1
InChIInChI=1S/C7H10N2O/c1-2-10-6-7-8-4-3-5-9-7/h3-5H,2,6H2,1H3
InChIKeyBIMRLBCIRDTAMM-UHFFFAOYSA-N
XLogP1.01
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(ethoxymethyl)pyrimidine?
The IUPAC name of 2-(ethoxymethyl)pyrimidine (CID 89045455) is 2-(ethoxymethyl)pyrimidine.
What is the SMILES notation for 2-(ethoxymethyl)pyrimidine?
The canonical SMILES for 2-(ethoxymethyl)pyrimidine is CCOCc1ncccn1.
What is the InChIKey of 2-(ethoxymethyl)pyrimidine?
The InChIKey is BIMRLBCIRDTAMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-2-10-6-7-8-4-3-5-9-7/h3-5H,2,6H2,1H3.
What are the key properties of 2-(ethoxymethyl)pyrimidine?
2-(ethoxymethyl)pyrimidine has a molecular weight of 138.17 g/mol, XLogP of 1.01, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethoxymethyl)pyrimidine is sourced from PubChem (CID 89045455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).