2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one

C14H18N2O2 — CID 15665473

IUPAC2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one
SMILESCOc1ccccc1N1CCN2CC(=O)CC2C1
InChIInChI=1S/C14H18N2O2/c1-18-14-5-3-2-4-13(14)16-7-6-15-10-12(17)8-11(15)9-16/h2-5,11H,6-10H2,1H3
InChIKeyUVBHUDNZCILCMZ-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.16
Rot. Bonds2

About 2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one

2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one (PubChem CID 15665473) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one
PubChem CID15665473
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one
SMILESCOc1ccccc1N1CCN2CC(=O)CC2C1
InChIInChI=1S/C14H18N2O2/c1-18-14-5-3-2-4-13(14)16-7-6-15-10-12(17)8-11(15)9-16/h2-5,11H,6-10H2,1H3
InChIKeyUVBHUDNZCILCMZ-UHFFFAOYSA-N
XLogP1.16
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-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-[4-(2-methoxyphenyl)piperazin-1-yl]cyclopentan-1-one
CID 112723099
4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-one
CID 10565307
4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-amine
CID 10708578
2-(2-methoxyphenyl)-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine
CID 79930320
1-(2-methoxyphenyl)-4-[(1S,3R)-3-methylcyclopentyl]piperazine
CID 782078
1-[(3R)-1-cyclobutylpiperidin-3-yl]-4-(2-methoxyphenyl)piperazine
CID 92709243
cyclobutyl-[3-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]methanone
CID 24719059
1-(2-methoxyphenyl)-4-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine
CID 7441356
1-(2-methoxyphenyl)-4-nitrosopiperazine
CID 154814146
1-[3-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]ethanone
CID 24719056
cyclohexyl-[(3R)-3-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]methanone
CID 42567976
1-(2-methoxyphenyl)-4-[(1R,2R)-2-methylcyclohexyl]piperazine
CID 124636506

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one?
The IUPAC name of 2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one (CID 15665473) is 2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one.
What is the SMILES notation for 2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one?
The canonical SMILES for 2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one is COc1ccccc1N1CCN2CC(=O)CC2C1.
What is the InChIKey of 2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one?
The InChIKey is UVBHUDNZCILCMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-18-14-5-3-2-4-13(14)16-7-6-15-10-12(17)8-11(15)9-16/h2-5,11H,6-10H2,1H3.
What are the key properties of 2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one?
2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one has a molecular weight of 246.31 g/mol, XLogP of 1.16, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one is sourced from PubChem (CID 15665473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).