5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one

C12H19N5O — CID 24816275

IUPAC5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one
SMILESCCC(CC)n1c(=O)[nH]c2ncc(N(C)C)nc21
InChIInChI=1S/C12H19N5O/c1-5-8(6-2)17-11-10(15-12(17)18)13-7-9(14-11)16(3)4/h7-8H,5-6H2,1-4H3,(H,13,15,18)
InChIKeyOOWPKYXJAWXXJL-UHFFFAOYSA-N
MW249.32 g/mol
LogP1.55
Rot. Bonds4

About 5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one

5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one (PubChem CID 24816275) has the molecular formula C12H19N5O and a molecular weight of 249.32 g/mol. Its IUPAC name is 5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one.

Molecular Properties

Compound Name5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one
PubChem CID24816275
Molecular FormulaC12H19N5O
Molecular Weight249.32 g/mol
Exact Mass249.16
IUPAC Name5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one
SMILESCCC(CC)n1c(=O)[nH]c2ncc(N(C)C)nc21
InChIInChI=1S/C12H19N5O/c1-5-8(6-2)17-11-10(15-12(17)18)13-7-9(14-11)16(3)4/h7-8H,5-6H2,1-4H3,(H,13,15,18)
InChIKeyOOWPKYXJAWXXJL-UHFFFAOYSA-N
XLogP1.55
TPSA66.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-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 5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one?
The IUPAC name of 5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one (CID 24816275) is 5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one.
What is the SMILES notation for 5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one?
The canonical SMILES for 5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one is CCC(CC)n1c(=O)[nH]c2ncc(N(C)C)nc21.
What is the InChIKey of 5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one?
The InChIKey is OOWPKYXJAWXXJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O/c1-5-8(6-2)17-11-10(15-12(17)18)13-7-9(14-11)16(3)4/h7-8H,5-6H2,1-4H3,(H,13,15,18).
What are the key properties of 5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one?
5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one has a molecular weight of 249.32 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one is sourced from PubChem (CID 24816275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).