4-cyclobutyloxy-2,6-dimethylpyrimidine

C10H14N2O — CID 126953843

IUPAC4-cyclobutyloxy-2,6-dimethylpyrimidine
SMILESCc1cc(OC2CCC2)nc(C)n1
InChIInChI=1S/C10H14N2O/c1-7-6-10(12-8(2)11-7)13-9-4-3-5-9/h6,9H,3-5H2,1-2H3
InChIKeyLBCRAVQDWZQHHB-UHFFFAOYSA-N
MW178.23 g/mol
LogP2.02
Rot. Bonds2

About 4-cyclobutyloxy-2,6-dimethylpyrimidine

4-cyclobutyloxy-2,6-dimethylpyrimidine (PubChem CID 126953843) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is 4-cyclobutyloxy-2,6-dimethylpyrimidine.

Molecular Properties

Compound Name4-cyclobutyloxy-2,6-dimethylpyrimidine
PubChem CID126953843
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name4-cyclobutyloxy-2,6-dimethylpyrimidine
SMILESCc1cc(OC2CCC2)nc(C)n1
InChIInChI=1S/C10H14N2O/c1-7-6-10(12-8(2)11-7)13-9-4-3-5-9/h6,9H,3-5H2,1-2H3
InChIKeyLBCRAVQDWZQHHB-UHFFFAOYSA-N
XLogP2.02
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-cyclobutyloxy-2,6-dimethylpyrimidine?
The IUPAC name of 4-cyclobutyloxy-2,6-dimethylpyrimidine (CID 126953843) is 4-cyclobutyloxy-2,6-dimethylpyrimidine.
What is the SMILES notation for 4-cyclobutyloxy-2,6-dimethylpyrimidine?
The canonical SMILES for 4-cyclobutyloxy-2,6-dimethylpyrimidine is Cc1cc(OC2CCC2)nc(C)n1.
What is the InChIKey of 4-cyclobutyloxy-2,6-dimethylpyrimidine?
The InChIKey is LBCRAVQDWZQHHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-7-6-10(12-8(2)11-7)13-9-4-3-5-9/h6,9H,3-5H2,1-2H3.
What are the key properties of 4-cyclobutyloxy-2,6-dimethylpyrimidine?
4-cyclobutyloxy-2,6-dimethylpyrimidine has a molecular weight of 178.23 g/mol, XLogP of 2.02, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyloxy-2,6-dimethylpyrimidine is sourced from PubChem (CID 126953843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).