2-chloro-6-ethoxy-7-methoxyquinazoline

C11H11ClN2O2 — CID 141299474

IUPAC2-chloro-6-ethoxy-7-methoxyquinazoline
SMILESCCOc1cc2cnc(Cl)nc2cc1OC
InChIInChI=1S/C11H11ClN2O2/c1-3-16-10-4-7-6-13-11(12)14-8(7)5-9(10)15-2/h4-6H,3H2,1-2H3
InChIKeyGMKFHXOEFROUBF-UHFFFAOYSA-N
MW238.67 g/mol
LogP2.69
Rot. Bonds3

About 2-chloro-6-ethoxy-7-methoxyquinazoline

2-chloro-6-ethoxy-7-methoxyquinazoline (PubChem CID 141299474) has the molecular formula C11H11ClN2O2 and a molecular weight of 238.67 g/mol. Its IUPAC name is 2-chloro-6-ethoxy-7-methoxyquinazoline.

Molecular Properties

Compound Name2-chloro-6-ethoxy-7-methoxyquinazoline
PubChem CID141299474
Molecular FormulaC11H11ClN2O2
Molecular Weight238.67 g/mol
Exact Mass238.05
IUPAC Name2-chloro-6-ethoxy-7-methoxyquinazoline
SMILESCCOc1cc2cnc(Cl)nc2cc1OC
InChIInChI=1S/C11H11ClN2O2/c1-3-16-10-4-7-6-13-11(12)14-8(7)5-9(10)15-2/h4-6H,3H2,1-2H3
InChIKeyGMKFHXOEFROUBF-UHFFFAOYSA-N
XLogP2.69
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.67
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-ethoxy-7-methoxyquinazoline?
The IUPAC name of 2-chloro-6-ethoxy-7-methoxyquinazoline (CID 141299474) is 2-chloro-6-ethoxy-7-methoxyquinazoline.
What is the SMILES notation for 2-chloro-6-ethoxy-7-methoxyquinazoline?
The canonical SMILES for 2-chloro-6-ethoxy-7-methoxyquinazoline is CCOc1cc2cnc(Cl)nc2cc1OC.
What is the InChIKey of 2-chloro-6-ethoxy-7-methoxyquinazoline?
The InChIKey is GMKFHXOEFROUBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2O2/c1-3-16-10-4-7-6-13-11(12)14-8(7)5-9(10)15-2/h4-6H,3H2,1-2H3.
What are the key properties of 2-chloro-6-ethoxy-7-methoxyquinazoline?
2-chloro-6-ethoxy-7-methoxyquinazoline has a molecular weight of 238.67 g/mol, XLogP of 2.69, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-ethoxy-7-methoxyquinazoline is sourced from PubChem (CID 141299474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).