ethane;5-methoxy-4,7-dimethylquinazoline

C15H24N2O — CID 176567251

IUPACethane;5-methoxy-4,7-dimethylquinazoline
SMILESCC.CC.COc1cc(C)cc2ncnc(C)c12
InChIInChI=1S/C11H12N2O.2C2H6/c1-7-4-9-11(10(5-7)14-3)8(2)12-6-13-9;2*1-2/h4-6H,1-3H3;2*1-2H3
InChIKeyYFEVVMUULDDSAW-UHFFFAOYSA-N
MW248.37 g/mol
LogP4.31
Rot. Bonds1

About ethane;5-methoxy-4,7-dimethylquinazoline

ethane;5-methoxy-4,7-dimethylquinazoline (PubChem CID 176567251) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is ethane;5-methoxy-4,7-dimethylquinazoline.

Molecular Properties

Compound Nameethane;5-methoxy-4,7-dimethylquinazoline
PubChem CID176567251
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Nameethane;5-methoxy-4,7-dimethylquinazoline
SMILESCC.CC.COc1cc(C)cc2ncnc(C)c12
InChIInChI=1S/C11H12N2O.2C2H6/c1-7-4-9-11(10(5-7)14-3)8(2)12-6-13-9;2*1-2/h4-6H,1-3H3;2*1-2H3
InChIKeyYFEVVMUULDDSAW-UHFFFAOYSA-N
XLogP4.31
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-methoxy-4,7-dimethylquinazoline
CID 176567252
6,7-dimethoxy-4-methylquinazoline
CID 4319422
7-fluoro-5-methoxyquinazolin-4-amine
CID 130019322
8-methoxy-4,5-dimethylquinazoline
CID 142290998
1,3-dimethoxy-2,5-dimethylbenzene
CID 524839
2-(1-hydroxy-4,5-dimethoxy-7-methylnaphthalen-2-yl)-4,5-dimethoxy-7-methylnaphthalen-1-ol
CID 101353677
6-cyclopropyl-7-methoxy-4-methylquinazoline
CID 167049426
6,7,8-trimethoxy-4-methylquinazoline
CID 70672853
4,6-dimethylquinazoline;ethane
CID 91475450
4-tert-butyl-5,6,7-trimethoxyquinazoline
CID 170974305
8-methoxy-4,6-dimethylquinoline
CID 58053088
4-(2-methoxy-5-methylphenyl)-6-methylpyrimidin-5-amine
CID 82391060

Frequently Asked Questions

What is the IUPAC name of ethane;5-methoxy-4,7-dimethylquinazoline?
The IUPAC name of ethane;5-methoxy-4,7-dimethylquinazoline (CID 176567251) is ethane;5-methoxy-4,7-dimethylquinazoline.
What is the SMILES notation for ethane;5-methoxy-4,7-dimethylquinazoline?
The canonical SMILES for ethane;5-methoxy-4,7-dimethylquinazoline is CC.CC.COc1cc(C)cc2ncnc(C)c12.
What is the InChIKey of ethane;5-methoxy-4,7-dimethylquinazoline?
The InChIKey is YFEVVMUULDDSAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O.2C2H6/c1-7-4-9-11(10(5-7)14-3)8(2)12-6-13-9;2*1-2/h4-6H,1-3H3;2*1-2H3.
What are the key properties of ethane;5-methoxy-4,7-dimethylquinazoline?
ethane;5-methoxy-4,7-dimethylquinazoline has a molecular weight of 248.37 g/mol, XLogP of 4.31, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methoxy-4,7-dimethylquinazoline is sourced from PubChem (CID 176567251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).