7-methoxy-1,4-dihydroquinazoline

C9H10N2O — CID 91363181

IUPAC7-methoxy-1,4-dihydroquinazoline
SMILESCOc1ccc2c(c1)NC=NC2
InChIInChI=1S/C9H10N2O/c1-12-8-3-2-7-5-10-6-11-9(7)4-8/h2-4,6H,5H2,1H3,(H,10,11)
InChIKeySRWBIYBWTDMCDY-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.65
Rot. Bonds1

About 7-methoxy-1,4-dihydroquinazoline

7-methoxy-1,4-dihydroquinazoline (PubChem CID 91363181) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 7-methoxy-1,4-dihydroquinazoline.

Molecular Properties

Compound Name7-methoxy-1,4-dihydroquinazoline
PubChem CID91363181
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name7-methoxy-1,4-dihydroquinazoline
SMILESCOc1ccc2c(c1)NC=NC2
InChIInChI=1S/C9H10N2O/c1-12-8-3-2-7-5-10-6-11-9(7)4-8/h2-4,6H,5H2,1H3,(H,10,11)
InChIKeySRWBIYBWTDMCDY-UHFFFAOYSA-N
XLogP1.65
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-1,4-dihydroquinazoline?
The IUPAC name of 7-methoxy-1,4-dihydroquinazoline (CID 91363181) is 7-methoxy-1,4-dihydroquinazoline.
What is the SMILES notation for 7-methoxy-1,4-dihydroquinazoline?
The canonical SMILES for 7-methoxy-1,4-dihydroquinazoline is COc1ccc2c(c1)NC=NC2.
What is the InChIKey of 7-methoxy-1,4-dihydroquinazoline?
The InChIKey is SRWBIYBWTDMCDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c1-12-8-3-2-7-5-10-6-11-9(7)4-8/h2-4,6H,5H2,1H3,(H,10,11).
What are the key properties of 7-methoxy-1,4-dihydroquinazoline?
7-methoxy-1,4-dihydroquinazoline has a molecular weight of 162.19 g/mol, XLogP of 1.65, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-1,4-dihydroquinazoline is sourced from PubChem (CID 91363181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).