5-ethoxy-2-(1-methylcyclopropyl)pyrimidine

C10H14N2O — CID 13292804

IUPAC5-ethoxy-2-(1-methylcyclopropyl)pyrimidine
SMILESCCOc1cnc(C2(C)CC2)nc1
InChIInChI=1S/C10H14N2O/c1-3-13-8-6-11-9(12-7-8)10(2)4-5-10/h6-7H,3-5H2,1-2H3
InChIKeyGLSMBAHPQPDRQU-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.93
Rot. Bonds3

About 5-ethoxy-2-(1-methylcyclopropyl)pyrimidine

5-ethoxy-2-(1-methylcyclopropyl)pyrimidine (PubChem CID 13292804) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is 5-ethoxy-2-(1-methylcyclopropyl)pyrimidine.

Molecular Properties

Compound Name5-ethoxy-2-(1-methylcyclopropyl)pyrimidine
PubChem CID13292804
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name5-ethoxy-2-(1-methylcyclopropyl)pyrimidine
SMILESCCOc1cnc(C2(C)CC2)nc1
InChIInChI=1S/C10H14N2O/c1-3-13-8-6-11-9(12-7-8)10(2)4-5-10/h6-7H,3-5H2,1-2H3
InChIKeyGLSMBAHPQPDRQU-UHFFFAOYSA-N
XLogP1.93
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-2-(1-methylcyclopropyl)pyrimidine?
The IUPAC name of 5-ethoxy-2-(1-methylcyclopropyl)pyrimidine (CID 13292804) is 5-ethoxy-2-(1-methylcyclopropyl)pyrimidine.
What is the SMILES notation for 5-ethoxy-2-(1-methylcyclopropyl)pyrimidine?
The canonical SMILES for 5-ethoxy-2-(1-methylcyclopropyl)pyrimidine is CCOc1cnc(C2(C)CC2)nc1.
What is the InChIKey of 5-ethoxy-2-(1-methylcyclopropyl)pyrimidine?
The InChIKey is GLSMBAHPQPDRQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-3-13-8-6-11-9(12-7-8)10(2)4-5-10/h6-7H,3-5H2,1-2H3.
What are the key properties of 5-ethoxy-2-(1-methylcyclopropyl)pyrimidine?
5-ethoxy-2-(1-methylcyclopropyl)pyrimidine has a molecular weight of 178.23 g/mol, XLogP of 1.93, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-2-(1-methylcyclopropyl)pyrimidine is sourced from PubChem (CID 13292804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).