2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline

C15H18N2O2 — CID 163275248

IUPAC2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline
SMILESCOc1cc2nc(C3CCC3)nc(C)c2cc1OC
InChIInChI=1S/C15H18N2O2/c1-9-11-7-13(18-2)14(19-3)8-12(11)17-15(16-9)10-5-4-6-10/h7-8,10H,4-6H2,1-3H3
InChIKeyQNNNWURCYQWTRW-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.22
Rot. Bonds3

About 2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline

2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline (PubChem CID 163275248) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline.

Molecular Properties

Compound Name2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline
PubChem CID163275248
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline
SMILESCOc1cc2nc(C3CCC3)nc(C)c2cc1OC
InChIInChI=1S/C15H18N2O2/c1-9-11-7-13(18-2)14(19-3)8-12(11)17-15(16-9)10-5-4-6-10/h7-8,10H,4-6H2,1-3H3
InChIKeyQNNNWURCYQWTRW-UHFFFAOYSA-N
XLogP3.22
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline?
The IUPAC name of 2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline (CID 163275248) is 2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline.
What is the SMILES notation for 2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline?
The canonical SMILES for 2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline is COc1cc2nc(C3CCC3)nc(C)c2cc1OC.
What is the InChIKey of 2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline?
The InChIKey is QNNNWURCYQWTRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-9-11-7-13(18-2)14(19-3)8-12(11)17-15(16-9)10-5-4-6-10/h7-8,10H,4-6H2,1-3H3.
What are the key properties of 2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline?
2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline has a molecular weight of 258.32 g/mol, XLogP of 3.22, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline is sourced from PubChem (CID 163275248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).