4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one

C11H15N3O — CID 129041418

IUPAC4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one
SMILESCN1C(=O)C2=C(CCCC2)N2CCN=C12
InChIInChI=1S/C11H15N3O/c1-13-10(15)8-4-2-3-5-9(8)14-7-6-12-11(13)14/h2-7H2,1H3
InChIKeySZVKFHKYRNWFET-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.96
Rot. Bonds

About 4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one

4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one (PubChem CID 129041418) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one.

Molecular Properties

Compound Name4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one
PubChem CID129041418
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one
SMILESCN1C(=O)C2=C(CCCC2)N2CCN=C12
InChIInChI=1S/C11H15N3O/c1-13-10(15)8-4-2-3-5-9(8)14-7-6-12-11(13)14/h2-7H2,1H3
InChIKeySZVKFHKYRNWFET-UHFFFAOYSA-N
XLogP0.96
TPSA35.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one?
The IUPAC name of 4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one (CID 129041418) is 4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one.
What is the SMILES notation for 4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one?
The canonical SMILES for 4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one is CN1C(=O)C2=C(CCCC2)N2CCN=C12.
What is the InChIKey of 4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one?
The InChIKey is SZVKFHKYRNWFET-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-13-10(15)8-4-2-3-5-9(8)14-7-6-12-11(13)14/h2-7H2,1H3.
What are the key properties of 4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one?
4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one has a molecular weight of 205.26 g/mol, XLogP of 0.96, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1,2,6,7,8,9-hexahydroimidazo[1,2-a]quinazolin-5-one is sourced from PubChem (CID 129041418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).