6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol

C12H13ClN4O — CID 135997687

IUPAC6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol
SMILESCN(C)c1ccc2c(c1Cl)CNc1nc(O)cn1-2
InChIInChI=1S/C12H13ClN4O/c1-16(2)9-4-3-8-7(11(9)13)5-14-12-15-10(18)6-17(8)12/h3-4,6,18H,5H2,1-2H3,(H,14,15)
InChIKeyCYMZVUXAAYYVPO-UHFFFAOYSA-N
MW264.72 g/mol
LogP2.22
Rot. Bonds1

About 6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol

6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol (PubChem CID 135997687) has the molecular formula C12H13ClN4O and a molecular weight of 264.72 g/mol. Its IUPAC name is 6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol.

Molecular Properties

Compound Name6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol
PubChem CID135997687
Molecular FormulaC12H13ClN4O
Molecular Weight264.72 g/mol
Exact Mass264.08
IUPAC Name6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol
SMILESCN(C)c1ccc2c(c1Cl)CNc1nc(O)cn1-2
InChIInChI=1S/C12H13ClN4O/c1-16(2)9-4-3-8-7(11(9)13)5-14-12-15-10(18)6-17(8)12/h3-4,6,18H,5H2,1-2H3,(H,14,15)
InChIKeyCYMZVUXAAYYVPO-UHFFFAOYSA-N
XLogP2.22
TPSA53.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.72
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

6,7-Dichloro-5,10-dihydroimidazo[2,1-b]quinazolin-2-ol--hydrogen chloride (1/1)
CID 60196296
6,7-Dichloro-5,10-dihydroimidazo[2,1-b]quinazolin-2-ol
CID 24868286
6-Chloro-3-methyl-1,5-dihydroimidazo[2,1-b]quinazolin-2-ol
CID 57046956
6-Chloro-4,5-dihydroimidazo[1,2-a]quinazoline
CID 135689648
5-Methyl-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol
CID 135967801
7-Methyl-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol
CID 135996315
6,7-Dimethyl-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol
CID 136027855
6-Chloro-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol
CID 136027862
9-Methyl-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol
CID 136051372
7-Chloro-6-methyl-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol
CID 136067004
6-(Dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol
CID 136076847
7-(Dimethylamino)-6-methyl-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol
CID 136077172

Frequently Asked Questions

What is the IUPAC name of 6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol?
The IUPAC name of 6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol (CID 135997687) is 6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol.
What is the SMILES notation for 6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol?
The canonical SMILES for 6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol is CN(C)c1ccc2c(c1Cl)CNc1nc(O)cn1-2.
What is the InChIKey of 6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol?
The InChIKey is CYMZVUXAAYYVPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN4O/c1-16(2)9-4-3-8-7(11(9)13)5-14-12-15-10(18)6-17(8)12/h3-4,6,18H,5H2,1-2H3,(H,14,15).
What are the key properties of 6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol?
6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol has a molecular weight of 264.72 g/mol, XLogP of 2.22, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-7-(dimethylamino)-4,5-dihydroimidazo[1,2-a]quinazolin-2-ol is sourced from PubChem (CID 135997687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).