8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine

C11H19N — CID 57052585

IUPAC8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine
SMILESCC12CCCC1CN1CCCC12
InChIInChI=1S/C11H19N/c1-11-6-2-4-9(11)8-12-7-3-5-10(11)12/h9-10H,2-8H2,1H3
InChIKeySXKKDEXANNSANB-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.27
Rot. Bonds

About 8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine

8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine (PubChem CID 57052585) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine.

Molecular Properties

Compound Name8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine
PubChem CID57052585
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine
SMILESCC12CCCC1CN1CCCC12
InChIInChI=1S/C11H19N/c1-11-6-2-4-9(11)8-12-7-3-5-10(11)12/h9-10H,2-8H2,1H3
InChIKeySXKKDEXANNSANB-UHFFFAOYSA-N
XLogP2.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,2-dimethylcyclopentyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 79944588
[1-(2,2-dimethylcyclopentyl)piperidin-3-yl]methanamine
CID 79857403
1-(2,2-dimethylcyclohexyl)piperidin-3-amine
CID 79847602
2-[1-(2,2-dimethylcyclopentyl)piperidin-3-yl]ethanamine
CID 79862196
2-(2,2-dimethylcyclohexyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79929028
7-methyl-7-propyl-1,2,3,5,6,8-hexahydropyrrolizine
CID 154510933
2-[(1-methylcyclopentyl)methyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 79939110
2-[(1-methylcyclobutyl)methyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 107094604
2-(2,2-dimethylcyclopentyl)-3-propan-2-yl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 79944735
cis-(1R,2R)-1-methyl-2-pyrrolidin-1-ylcyclohexan-1-ol
CID 101409360
6-chloro-6,8-dimethyl-1,2,3,5,7,8a-hexahydroindolizin-8-ol
CID 86147985
(27S)-5,21,26,26-tetramethyl-1-azabicyclo[25.8.0]pentatriacontane
CID 155003765

Frequently Asked Questions

What is the IUPAC name of 8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine?
The IUPAC name of 8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine (CID 57052585) is 8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine.
What is the SMILES notation for 8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine?
The canonical SMILES for 8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine is CC12CCCC1CN1CCCC12.
What is the InChIKey of 8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine?
The InChIKey is SXKKDEXANNSANB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-11-6-2-4-9(11)8-12-7-3-5-10(11)12/h9-10H,2-8H2,1H3.
What are the key properties of 8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine?
8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine has a molecular weight of 165.28 g/mol, XLogP of 2.27, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8a-methyl-2,3,5,5a,6,7,8,8b-octahydro-1H-cyclopenta[a]pyrrolizine is sourced from PubChem (CID 57052585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).