4-ethyl-6,7-dimethoxyquinazoline

C12H14N2O2 — CID 19918

IUPAC4-ethyl-6,7-dimethoxyquinazoline
SMILESCCc1ncnc2cc(OC)c(OC)cc12
InChIInChI=1S/C12H14N2O2/c1-4-9-8-5-11(15-2)12(16-3)6-10(8)14-7-13-9/h5-7H,4H2,1-3H3
InChIKeySTAYVYIMUXVGBN-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.21
Rot. Bonds3

About 4-ethyl-6,7-dimethoxyquinazoline

4-ethyl-6,7-dimethoxyquinazoline (PubChem CID 19918) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 4-ethyl-6,7-dimethoxyquinazoline.

Molecular Properties

Compound Name4-ethyl-6,7-dimethoxyquinazoline
PubChem CID19918
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name4-ethyl-6,7-dimethoxyquinazoline
SMILESCCc1ncnc2cc(OC)c(OC)cc12
InChIInChI=1S/C12H14N2O2/c1-4-9-8-5-11(15-2)12(16-3)6-10(8)14-7-13-9/h5-7H,4H2,1-3H3
InChIKeySTAYVYIMUXVGBN-UHFFFAOYSA-N
XLogP2.21
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Erlotinib
CID 176870
Erlotinib Hydrochloride
CID 176871
N-(3-Chlorophenyl)-6,7-dimethoxy-4-quinazolinamine
CID 2051
Bunazosin
CID 2472
PD-153035
CID 4705
Icotinib
CID 22024915
2-(1-Piperazinyl)-4-amino-6,7-dimethoxyquinazoline
CID 616267
7-Methoxyquinazoline
CID 12213273
2-Chloro-6,7-dimethoxy-4-quinazolinamine
CID 90235
Abanoquil
CID 164089
4-(3-Bromoanilino)-6,7-diethoxyquinazoline
CID 2857
6,7-dimethoxy-N-phenylquinazolin-4-amine
CID 3798

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6,7-dimethoxyquinazoline?
The IUPAC name of 4-ethyl-6,7-dimethoxyquinazoline (CID 19918) is 4-ethyl-6,7-dimethoxyquinazoline.
What is the SMILES notation for 4-ethyl-6,7-dimethoxyquinazoline?
The canonical SMILES for 4-ethyl-6,7-dimethoxyquinazoline is CCc1ncnc2cc(OC)c(OC)cc12.
What is the InChIKey of 4-ethyl-6,7-dimethoxyquinazoline?
The InChIKey is STAYVYIMUXVGBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-4-9-8-5-11(15-2)12(16-3)6-10(8)14-7-13-9/h5-7H,4H2,1-3H3.
What are the key properties of 4-ethyl-6,7-dimethoxyquinazoline?
4-ethyl-6,7-dimethoxyquinazoline has a molecular weight of 218.26 g/mol, XLogP of 2.21, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6,7-dimethoxyquinazoline is sourced from PubChem (CID 19918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).