2-cyclopropyl-6,7-dimethoxyquinazoline

C13H14N2O2 — CID 90237474

IUPAC2-cyclopropyl-6,7-dimethoxyquinazoline
SMILESCOc1cc2cnc(C3CC3)nc2cc1OC
InChIInChI=1S/C13H14N2O2/c1-16-11-5-9-7-14-13(8-3-4-8)15-10(9)6-12(11)17-2/h5-8H,3-4H2,1-2H3
InChIKeyDPWRTOKVSYDFCX-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.52
Rot. Bonds3

About 2-cyclopropyl-6,7-dimethoxyquinazoline

2-cyclopropyl-6,7-dimethoxyquinazoline (PubChem CID 90237474) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-cyclopropyl-6,7-dimethoxyquinazoline.

Molecular Properties

Compound Name2-cyclopropyl-6,7-dimethoxyquinazoline
PubChem CID90237474
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name2-cyclopropyl-6,7-dimethoxyquinazoline
SMILESCOc1cc2cnc(C3CC3)nc2cc1OC
InChIInChI=1S/C13H14N2O2/c1-16-11-5-9-7-14-13(8-3-4-8)15-10(9)6-12(11)17-2/h5-8H,3-4H2,1-2H3
InChIKeyDPWRTOKVSYDFCX-UHFFFAOYSA-N
XLogP2.52
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6,7-dimethoxyquinazoline?
The IUPAC name of 2-cyclopropyl-6,7-dimethoxyquinazoline (CID 90237474) is 2-cyclopropyl-6,7-dimethoxyquinazoline.
What is the SMILES notation for 2-cyclopropyl-6,7-dimethoxyquinazoline?
The canonical SMILES for 2-cyclopropyl-6,7-dimethoxyquinazoline is COc1cc2cnc(C3CC3)nc2cc1OC.
What is the InChIKey of 2-cyclopropyl-6,7-dimethoxyquinazoline?
The InChIKey is DPWRTOKVSYDFCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-16-11-5-9-7-14-13(8-3-4-8)15-10(9)6-12(11)17-2/h5-8H,3-4H2,1-2H3.
What are the key properties of 2-cyclopropyl-6,7-dimethoxyquinazoline?
2-cyclopropyl-6,7-dimethoxyquinazoline has a molecular weight of 230.27 g/mol, XLogP of 2.52, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6,7-dimethoxyquinazoline is sourced from PubChem (CID 90237474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).