3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one

C9H11N3O2 — CID 155783801

IUPAC3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one
SMILESO=c1[nH]ccnc1N1CC2(COC2)C1
InChIInChI=1S/C9H11N3O2/c13-8-7(10-1-2-11-8)12-3-9(4-12)5-14-6-9/h1-2H,3-6H2,(H,11,13)
InChIKeyZUPNQFZMQBSFQW-UHFFFAOYSA-N
MW193.21 g/mol
LogP-0.39
Rot. Bonds1

About 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one

3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one (PubChem CID 155783801) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one.

Molecular Properties

Compound Name3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one
PubChem CID155783801
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC Name3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one
SMILESO=c1[nH]ccnc1N1CC2(COC2)C1
InChIInChI=1S/C9H11N3O2/c13-8-7(10-1-2-11-8)12-3-9(4-12)5-14-6-9/h1-2H,3-6H2,(H,11,13)
InChIKeyZUPNQFZMQBSFQW-UHFFFAOYSA-N
XLogP-0.39
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-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

Related Compounds

3-(3-amino-3-ethylazetidin-1-yl)-1H-pyrazin-2-one
CID 114571479
3-(1,1-dioxo-1,4-thiazinan-4-yl)-1H-pyrazin-2-one
CID 115684957
3-[5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-6-oxo-1H-pyrazin-3-yl]propanal
CID 153363100
3-(4-methylpiperidin-1-yl)-1H-pyrazin-2-one
CID 115650167
3-[3-(hydroxymethyl)azetidin-1-yl]-1H-pyrazin-2-one
CID 114571125
3-methyl-1-(2-oxo-1H-pyrazin-3-yl)pyrrolidine-3-carboxylic acid
CID 114570487
3-(7-azabicyclo[2.2.1]heptan-7-yl)-1H-pyrazin-2-one
CID 126856968
1-(2-oxo-1H-pyrazin-3-yl)-1,4-diazepan-5-one
CID 115657445
3-[(3S)-3-aminopyrrolidin-1-yl]-1H-pyrazin-2-one
CID 129394339
3-[4-(2-hydroxyethyl)piperazin-1-yl]-1H-pyrazin-2-one
CID 115650168
3-[4-(4-aminophenyl)piperazin-1-yl]-1H-pyrazin-2-one
CID 114571063
3-(4-methylazepan-1-yl)-1H-pyrazin-2-one
CID 115650237

Frequently Asked Questions

What is the IUPAC name of 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one?
The IUPAC name of 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one (CID 155783801) is 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one.
What is the SMILES notation for 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one?
The canonical SMILES for 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one is O=c1[nH]ccnc1N1CC2(COC2)C1.
What is the InChIKey of 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one?
The InChIKey is ZUPNQFZMQBSFQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c13-8-7(10-1-2-11-8)12-3-9(4-12)5-14-6-9/h1-2H,3-6H2,(H,11,13).
What are the key properties of 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one?
3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one has a molecular weight of 193.21 g/mol, XLogP of -0.39, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1H-pyrazin-2-one is sourced from PubChem (CID 155783801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).