4-cyclohexyloxyquinazoline

C14H16N2O — CID 44591868

IUPAC4-cyclohexyloxyquinazoline
SMILESc1ccc2c(OC3CCCCC3)ncnc2c1
InChIInChI=1S/C14H16N2O/c1-2-6-11(7-3-1)17-14-12-8-4-5-9-13(12)15-10-16-14/h4-5,8-11H,1-3,6-7H2
InChIKeyQNXOLVQGDILPJV-UHFFFAOYSA-N
MW228.30 g/mol
LogP3.34
Rot. Bonds2

About 4-cyclohexyloxyquinazoline

4-cyclohexyloxyquinazoline (PubChem CID 44591868) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 4-cyclohexyloxyquinazoline.

Molecular Properties

Compound Name4-cyclohexyloxyquinazoline
PubChem CID44591868
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name4-cyclohexyloxyquinazoline
SMILESc1ccc2c(OC3CCCCC3)ncnc2c1
InChIInChI=1S/C14H16N2O/c1-2-6-11(7-3-1)17-14-12-8-4-5-9-13(12)15-10-16-14/h4-5,8-11H,1-3,6-7H2
InChIKeyQNXOLVQGDILPJV-UHFFFAOYSA-N
XLogP3.34
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-cyclohexyloxyquinazoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyloxyquinazoline?
The IUPAC name of 4-cyclohexyloxyquinazoline (CID 44591868) is 4-cyclohexyloxyquinazoline.
What is the SMILES notation for 4-cyclohexyloxyquinazoline?
The canonical SMILES for 4-cyclohexyloxyquinazoline is c1ccc2c(OC3CCCCC3)ncnc2c1.
What is the InChIKey of 4-cyclohexyloxyquinazoline?
The InChIKey is QNXOLVQGDILPJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-2-6-11(7-3-1)17-14-12-8-4-5-9-13(12)15-10-16-14/h4-5,8-11H,1-3,6-7H2.
What are the key properties of 4-cyclohexyloxyquinazoline?
4-cyclohexyloxyquinazoline has a molecular weight of 228.30 g/mol, XLogP of 3.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyloxyquinazoline is sourced from PubChem (CID 44591868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).