(3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol

C8H15NO — CID 147950414

IUPAC(3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol
SMILESCN1C[C@H]2CC(O)C[C@H]2C1
InChIInChI=1S/C8H15NO/c1-9-4-6-2-8(10)3-7(6)5-9/h6-8,10H,2-5H2,1H3/t6-,7+,8?
InChIKeyINMRQPCQBZXSTH-DHBOJHSNSA-N
MW141.21 g/mol
LogP0.32
Rot. Bonds

About (3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol

(3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol (PubChem CID 147950414) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol.

Molecular Properties

Compound Name(3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol
PubChem CID147950414
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol
SMILESCN1C[C@H]2CC(O)C[C@H]2C1
InChIInChI=1S/C8H15NO/c1-9-4-6-2-8(10)3-7(6)5-9/h6-8,10H,2-5H2,1H3/t6-,7+,8?
InChIKeyINMRQPCQBZXSTH-DHBOJHSNSA-N
XLogP0.32
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol with MolForge

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Related Compounds

9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol
CID 115013780
3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine
CID 142484502
3,7-dimethyl-3-azabicyclo[3.3.1]nonan-9-ol
CID 115013655
(6R)-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol
CID 122450712
N,2-dimethyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-amine
CID 59398149
but-2-yne;3-methyl-3-azabicyclo[3.1.0]hexane;molecular hydrogen
CID 170630185
ethane;3-methyl-3-azabicyclo[3.1.0]hexane;1-methylazetidine;1-methylpyrrolidine
CID 162220715
1,6-dimethylazepan-3-ol
CID 118230247
1,4-dimethyl-1,4-diazepan-6-ol
CID 14999065
2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 12847769
(3aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 142336980
(3aS,6aR)-2-methyl-5-(2-methylpropyl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 118457215

Frequently Asked Questions

What is the IUPAC name of (3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol?
The IUPAC name of (3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol (CID 147950414) is (3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol.
What is the SMILES notation for (3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol?
The canonical SMILES for (3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol is CN1C[C@H]2CC(O)C[C@H]2C1.
What is the InChIKey of (3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol?
The InChIKey is INMRQPCQBZXSTH-DHBOJHSNSA-N. The full InChI is InChI=1S/C8H15NO/c1-9-4-6-2-8(10)3-7(6)5-9/h6-8,10H,2-5H2,1H3/t6-,7+,8?.
What are the key properties of (3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol?
(3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol has a molecular weight of 141.21 g/mol, XLogP of 0.32, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol is sourced from PubChem (CID 147950414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).