6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine

C9H18N2 — CID 72528013

IUPAC6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
SMILESCC1(C)CCC2CNCCN21
InChIInChI=1S/C9H18N2/c1-9(2)4-3-8-7-10-5-6-11(8)9/h8,10H,3-7H2,1-2H3
InChIKeyWAANKBFZUWDGAB-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.83
Rot. Bonds

About 6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine

6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine (PubChem CID 72528013) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine.

Molecular Properties

Compound Name6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
PubChem CID72528013
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
SMILESCC1(C)CCC2CNCCN21
InChIInChI=1S/C9H18N2/c1-9(2)4-3-8-7-10-5-6-11(8)9/h8,10H,3-7H2,1-2H3
InChIKeyWAANKBFZUWDGAB-UHFFFAOYSA-N
XLogP0.83
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine with MolForge

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Related Compounds

1-(3,3-dimethylcyclopentyl)-2,2-dimethylpiperazine
CID 80698651
1-cyclobutyl-2,2-dimethylpiperazine
CID 59454526
1-cycloheptyl-2,2-dimethylpiperazine
CID 65460692
1-(3,3-dimethylcyclopentyl)-2-propan-2-ylpiperazine
CID 114551197
1-(4-tert-butylcyclohexyl)-2,2-dimethylpiperazine
CID 65462507
(8aR)-3,3-dimethyl-1,2,5,6,8,8a-hexahydroindolizin-7-one
CID 129404067
2-methylspiro[3,6,7,8,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazine-4,1'-cyclopentane]
CID 82394990
4-(2,2-dimethylpiperazin-1-yl)-1-methylazepane
CID 65461906
2,2-dimethyl-1-(oxan-3-yl)piperazine
CID 65460906
2,2-dimethyl-1-(1-oxaspiro[5.5]undecan-4-yl)piperazine
CID 79902972
1-(2,2-dimethylcyclopentyl)-2,2-dimethylpiperazine
CID 79862905
4-(2,2-dimethylpiperazin-1-yl)-1-ethylazepane
CID 65463327

Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine?
The IUPAC name of 6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine (CID 72528013) is 6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine.
What is the SMILES notation for 6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine?
The canonical SMILES for 6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine is CC1(C)CCC2CNCCN21.
What is the InChIKey of 6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine?
The InChIKey is WAANKBFZUWDGAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-9(2)4-3-8-7-10-5-6-11(8)9/h8,10H,3-7H2,1-2H3.
What are the key properties of 6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine?
6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine has a molecular weight of 154.26 g/mol, XLogP of 0.83, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine is sourced from PubChem (CID 72528013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).