3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one

C12H13N3O — CID 135711148

IUPAC3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
SMILESCc1ccc2c(c1)CN1C(=N2)NC(=O)C1C
InChIInChI=1S/C12H13N3O/c1-7-3-4-10-9(5-7)6-15-8(2)11(16)14-12(15)13-10/h3-5,8H,6H2,1-2H3,(H,13,14,16)
InChIKeyHPCUPARCKXNYFX-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.32
Rot. Bonds

About 3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one

3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one (PubChem CID 135711148) has the molecular formula C12H13N3O and a molecular weight of 215.26 g/mol. Its IUPAC name is 3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one.

Molecular Properties

Compound Name3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
PubChem CID135711148
Molecular FormulaC12H13N3O
Molecular Weight215.26 g/mol
Exact Mass215.11
IUPAC Name3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
SMILESCc1ccc2c(c1)CN1C(=N2)NC(=O)C1C
InChIInChI=1S/C12H13N3O/c1-7-3-4-10-9(5-7)6-15-8(2)11(16)14-12(15)13-10/h3-5,8H,6H2,1-2H3,(H,13,14,16)
InChIKeyHPCUPARCKXNYFX-UHFFFAOYSA-N
XLogP1.32
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one?
The IUPAC name of 3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one (CID 135711148) is 3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one.
What is the SMILES notation for 3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one?
The canonical SMILES for 3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one is Cc1ccc2c(c1)CN1C(=N2)NC(=O)C1C.
What is the InChIKey of 3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one?
The InChIKey is HPCUPARCKXNYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O/c1-7-3-4-10-9(5-7)6-15-8(2)11(16)14-12(15)13-10/h3-5,8H,6H2,1-2H3,(H,13,14,16).
What are the key properties of 3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one?
3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one has a molecular weight of 215.26 g/mol, XLogP of 1.32, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dimethyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one is sourced from PubChem (CID 135711148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).