4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one

C14H14N4O — CID 106953118

IUPAC4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one
SMILESCC(C)C1N=C(c2ccc3nccnc3c2)NC1=O
InChIInChI=1S/C14H14N4O/c1-8(2)12-14(19)18-13(17-12)9-3-4-10-11(7-9)16-6-5-15-10/h3-8,12H,1-2H3,(H,17,18,19)
InChIKeyIQHXZDFANZHSHU-UHFFFAOYSA-N
MW254.29 g/mol
LogP1.53
Rot. Bonds2

About 4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one

4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one (PubChem CID 106953118) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one
PubChem CID106953118
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one
SMILESCC(C)C1N=C(c2ccc3nccnc3c2)NC1=O
InChIInChI=1S/C14H14N4O/c1-8(2)12-14(19)18-13(17-12)9-3-4-10-11(7-9)16-6-5-15-10/h3-8,12H,1-2H3,(H,17,18,19)
InChIKeyIQHXZDFANZHSHU-UHFFFAOYSA-N
XLogP1.53
TPSA67.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one?
The IUPAC name of 4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one (CID 106953118) is 4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one?
The canonical SMILES for 4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one is CC(C)C1N=C(c2ccc3nccnc3c2)NC1=O.
What is the InChIKey of 4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one?
The InChIKey is IQHXZDFANZHSHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c1-8(2)12-14(19)18-13(17-12)9-3-4-10-11(7-9)16-6-5-15-10/h3-8,12H,1-2H3,(H,17,18,19).
What are the key properties of 4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one?
4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one has a molecular weight of 254.29 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-2-quinoxalin-6-yl-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 106953118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).