2-cyclohexyloxypyrimidine

C10H14N2O — CID 88984869

IUPAC2-cyclohexyloxypyrimidine
SMILESc1cnc(OC2CCCCC2)nc1
InChIInChI=1S/C10H14N2O/c1-2-5-9(6-3-1)13-10-11-7-4-8-12-10/h4,7-9H,1-3,5-6H2
InChIKeyOXLKYYSWKHXXOH-UHFFFAOYSA-N
MW178.24 g/mol
LogP2.19
Rot. Bonds2

About 2-cyclohexyloxypyrimidine

2-cyclohexyloxypyrimidine (PubChem CID 88984869) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is 2-cyclohexyloxypyrimidine.

Molecular Properties

Compound Name2-cyclohexyloxypyrimidine
PubChem CID88984869
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name2-cyclohexyloxypyrimidine
SMILESc1cnc(OC2CCCCC2)nc1
InChIInChI=1S/C10H14N2O/c1-2-5-9(6-3-1)13-10-11-7-4-8-12-10/h4,7-9H,1-3,5-6H2
InChIKeyOXLKYYSWKHXXOH-UHFFFAOYSA-N
XLogP2.19
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxypyrimidine?
The IUPAC name of 2-cyclohexyloxypyrimidine (CID 88984869) is 2-cyclohexyloxypyrimidine.
What is the SMILES notation for 2-cyclohexyloxypyrimidine?
The canonical SMILES for 2-cyclohexyloxypyrimidine is c1cnc(OC2CCCCC2)nc1.
What is the InChIKey of 2-cyclohexyloxypyrimidine?
The InChIKey is OXLKYYSWKHXXOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-2-5-9(6-3-1)13-10-11-7-4-8-12-10/h4,7-9H,1-3,5-6H2.
What are the key properties of 2-cyclohexyloxypyrimidine?
2-cyclohexyloxypyrimidine has a molecular weight of 178.24 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxypyrimidine is sourced from PubChem (CID 88984869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).