2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one

C10H19N3O2 — CID 70418650

IUPAC2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one
SMILESCC1(C)C2CNCCN2C(=O)N1CCO
InChIInChI=1S/C10H19N3O2/c1-10(2)8-7-11-3-4-12(8)9(15)13(10)5-6-14/h8,11,14H,3-7H2,1-2H3
InChIKeyHAUOFQHQIGZFEW-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.53
Rot. Bonds2

About 2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one

2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one (PubChem CID 70418650) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one.

Molecular Properties

Compound Name2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one
PubChem CID70418650
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one
SMILESCC1(C)C2CNCCN2C(=O)N1CCO
InChIInChI=1S/C10H19N3O2/c1-10(2)8-7-11-3-4-12(8)9(15)13(10)5-6-14/h8,11,14H,3-7H2,1-2H3
InChIKeyHAUOFQHQIGZFEW-UHFFFAOYSA-N
XLogP-0.53
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-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 2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one?
The IUPAC name of 2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one (CID 70418650) is 2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one.
What is the SMILES notation for 2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one?
The canonical SMILES for 2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one is CC1(C)C2CNCCN2C(=O)N1CCO.
What is the InChIKey of 2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one?
The InChIKey is HAUOFQHQIGZFEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-10(2)8-7-11-3-4-12(8)9(15)13(10)5-6-14/h8,11,14H,3-7H2,1-2H3.
What are the key properties of 2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one?
2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one has a molecular weight of 213.28 g/mol, XLogP of -0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethyl)-1,1-dimethyl-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyrazin-3-one is sourced from PubChem (CID 70418650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).