7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one

C10H11N3O — CID 16956491

IUPAC7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one
SMILESO=c1[nH]ccn2nc3c(c12)CCCC3
InChIInChI=1S/C10H11N3O/c14-10-9-7-3-1-2-4-8(7)12-13(9)6-5-11-10/h5-6H,1-4H2,(H,11,14)
InChIKeyYQKBERUHRFHVMR-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.90
Rot. Bonds

About 7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one

7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one (PubChem CID 16956491) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one.

Molecular Properties

Compound Name7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one
PubChem CID16956491
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one
SMILESO=c1[nH]ccn2nc3c(c12)CCCC3
InChIInChI=1S/C10H11N3O/c14-10-9-7-3-1-2-4-8(7)12-13(9)6-5-11-10/h5-6H,1-4H2,(H,11,14)
InChIKeyYQKBERUHRFHVMR-UHFFFAOYSA-N
XLogP0.90
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-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 7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one?
The IUPAC name of 7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one (CID 16956491) is 7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one.
What is the SMILES notation for 7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one?
The canonical SMILES for 7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one is O=c1[nH]ccn2nc3c(c12)CCCC3.
What is the InChIKey of 7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one?
The InChIKey is YQKBERUHRFHVMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c14-10-9-7-3-1-2-4-8(7)12-13(9)6-5-11-10/h5-6H,1-4H2,(H,11,14).
What are the key properties of 7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one?
7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one has a molecular weight of 189.22 g/mol, XLogP of 0.90, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8,9,10-tetrahydro-2H-pyrazino[1,2-b]indazol-1-one is sourced from PubChem (CID 16956491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).