1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol

C10H11N3O — CID 115017791

IUPAC1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol
SMILESOc1ccc2c(c1)NCC1=NCCN12
InChIInChI=1S/C10H11N3O/c14-7-1-2-9-8(5-7)12-6-10-11-3-4-13(9)10/h1-2,5,12,14H,3-4,6H2
InChIKeyIJMJKGROELDILY-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.04
Rot. Bonds

About 1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol

1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol (PubChem CID 115017791) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol.

Molecular Properties

Compound Name1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol
PubChem CID115017791
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol
SMILESOc1ccc2c(c1)NCC1=NCCN12
InChIInChI=1S/C10H11N3O/c14-7-1-2-9-8(5-7)12-6-10-11-3-4-13(9)10/h1-2,5,12,14H,3-4,6H2
InChIKeyIJMJKGROELDILY-UHFFFAOYSA-N
XLogP1.04
TPSA47.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol?
The IUPAC name of 1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol (CID 115017791) is 1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol.
What is the SMILES notation for 1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol?
The canonical SMILES for 1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol is Oc1ccc2c(c1)NCC1=NCCN12.
What is the InChIKey of 1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol?
The InChIKey is IJMJKGROELDILY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c14-7-1-2-9-8(5-7)12-6-10-11-3-4-13(9)10/h1-2,5,12,14H,3-4,6H2.
What are the key properties of 1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol?
1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol has a molecular weight of 189.22 g/mol, XLogP of 1.04, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4,5-tetrahydroimidazo[1,2-a]quinoxalin-7-ol is sourced from PubChem (CID 115017791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).