7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one

C12H14N4O — CID 135621703

IUPAC7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
SMILESCN(C)c1ccc2c(c1)CN1CC(=O)NC1=N2
InChIInChI=1S/C12H14N4O/c1-15(2)9-3-4-10-8(5-9)6-16-7-11(17)14-12(16)13-10/h3-5H,6-7H2,1-2H3,(H,13,14,17)
InChIKeyCGZZITAXEIMIKS-UHFFFAOYSA-N
MW230.27 g/mol
LogP0.69
Rot. Bonds1

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

7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one (PubChem CID 135621703) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one.

Molecular Properties

Compound Name7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
PubChem CID135621703
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
SMILESCN(C)c1ccc2c(c1)CN1CC(=O)NC1=N2
InChIInChI=1S/C12H14N4O/c1-15(2)9-3-4-10-8(5-9)6-16-7-11(17)14-12(16)13-10/h3-5H,6-7H2,1-2H3,(H,13,14,17)
InChIKeyCGZZITAXEIMIKS-UHFFFAOYSA-N
XLogP0.69
TPSA47.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

1,5-Dihydro-7-(1-piperidinyl)-imidazo(2,1-b)quinazolin-2(3H)-one
CID 135410273
6-Methyl-1,2,3,5-tetrahydroimidazo(2,1-b)quinazolin-2-one hydrochloride
CID 135492314
BL-3459 free base
CID 135449336
7-Iodo-3,5-dihydroimidazo[2,1-b]quinazolin-2(1H)-one
CID 135583531
(1E)-1-(1-methyl-4-oxoimidazolidin-2-ylidene)-3-(3-methylphenyl)urea
CID 136106112
DN-9693
CID 135418419
3-Cyclohexyl-2-(2-ethyl-phenylamino)-3,5-dihydro-imidazol-4-one
CID 649300
3-Benzyl-2-(2-ethyl-phenylamino)-3,5-dihydro-imidazol-4-one
CID 655009
3-Phenethyl-2-m-tolylamino-3,5-dihydro-imidazol-4-one
CID 1454452
3-Allyl-2-(2,5-dimethyl-phenylamino)-3,5-dihydro-imidazol-4-one
CID 6602624
1-(1-Methyl-2-oxo-5-pyrrolidin-1-yl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-3-m-tolyl-urea
CID 10453063
8-chloro-7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
CID 136002143

Frequently Asked Questions

What is the IUPAC name of 7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one?
The IUPAC name of 7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one (CID 135621703) is 7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one.
What is the SMILES notation for 7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one?
The canonical SMILES for 7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one is CN(C)c1ccc2c(c1)CN1CC(=O)NC1=N2.
What is the InChIKey of 7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one?
The InChIKey is CGZZITAXEIMIKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-15(2)9-3-4-10-8(5-9)6-16-7-11(17)14-12(16)13-10/h3-5H,6-7H2,1-2H3,(H,13,14,17).
What are the key properties of 7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one?
7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one has a molecular weight of 230.27 g/mol, XLogP of 0.69, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(dimethylamino)-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one is sourced from PubChem (CID 135621703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).