2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine

C11H23N3 — CID 102571338

IUPAC2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine
SMILESCN(C)CCN1CCNC2CCCC21
InChIInChI=1S/C11H23N3/c1-13(2)8-9-14-7-6-12-10-4-3-5-11(10)14/h10-12H,3-9H2,1-2H3
InChIKeyJOQAZVHMACWVIE-UHFFFAOYSA-N
MW197.33 g/mol
LogP0.37
Rot. Bonds3

About 2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine

2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine (PubChem CID 102571338) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is 2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine
PubChem CID102571338
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine
SMILESCN(C)CCN1CCNC2CCCC21
InChIInChI=1S/C11H23N3/c1-13(2)8-9-14-7-6-12-10-4-3-5-11(10)14/h10-12H,3-9H2,1-2H3
InChIKeyJOQAZVHMACWVIE-UHFFFAOYSA-N
XLogP0.37
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine with MolForge

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Related Compounds

3-Methyl-octahydropyrrolo(1,2-a)piperazine
CID 18958803
1-Cyclopentylpiperazine
CID 806421
1-Methyloctahydropyrrolo(1,2-a)pyrazine
CID 44827712
Methyl(1-(piperidin-1-yl)propan-2-yl)amine
CID 17999034
(3S,8aS)-Octahydro-3-methyl-pyrrolo[1,2-a]pyrazine
CID 24903578
(3S,8aS)-3-Ethyloctahydro-pyrrolo(1,2-a)pyrazine
CID 54775527
4-methyl-octahydro-1H-pyrrolo[3,2-b]pyridine
CID 59170708
rac-(3aR,7aR)-1-methyl-octahydro-1H-pyrrolo(3,2-b)pyridine
CID 92845000
3-Isopropyloctahydropyrrolo[1,2-a]pyrazine
CID 71669028
rac-(1R,2R)-2-(4-methylpiperazin-1-yl)cyclopentan-1-amine
CID 30428457
(3S,8aR)-Octahydro-3-methyl-pyrrolo[1,2-a]pyrazine
CID 30883566
(3S)-1-cyclopentylpiperidin-3-amine
CID 39221461

Frequently Asked Questions

What is the IUPAC name of 2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine?
The IUPAC name of 2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine (CID 102571338) is 2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine?
The canonical SMILES for 2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine is CN(C)CCN1CCNC2CCCC21.
What is the InChIKey of 2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine?
The InChIKey is JOQAZVHMACWVIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-13(2)8-9-14-7-6-12-10-4-3-5-11(10)14/h10-12H,3-9H2,1-2H3.
What are the key properties of 2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine?
2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine has a molecular weight of 197.33 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine is sourced from PubChem (CID 102571338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).