1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol

C11H20N2O — CID 126845063

IUPAC1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol
SMILESOC1CCN(C2CCC3CNCC32)C1
InChIInChI=1S/C11H20N2O/c14-9-3-4-13(7-9)11-2-1-8-5-12-6-10(8)11/h8-12,14H,1-7H2
InChIKeyASGHGNPFSGZYME-UHFFFAOYSA-N
MW196.29 g/mol
LogP0.05
Rot. Bonds1

About 1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol

1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol (PubChem CID 126845063) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol.

Molecular Properties

Compound Name1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol
PubChem CID126845063
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol
SMILESOC1CCN(C2CCC3CNCC32)C1
InChIInChI=1S/C11H20N2O/c14-9-3-4-13(7-9)11-2-1-8-5-12-6-10(8)11/h8-12,14H,1-7H2
InChIKeyASGHGNPFSGZYME-UHFFFAOYSA-N
XLogP0.05
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol with MolForge

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Related Compounds

1-(azetidin-3-yl)pyrrolidin-3-ol
CID 55278856
4-pyrrolidin-1-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindole
CID 146675751
(3aS,4R,6aS)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-ol
CID 99123348
(2aS,8bR)-1,2,2a,3,5,6,7,8,8a,8b-decahydrocyclobuta[a]indolizin-7-ol
CID 82413598
1-pyrrolidin-3-ylpyrrolidin-3-ol
CID 53407971
(3aR,4R,6aS)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-ol;hydrochloride
CID 91800946
(3R)-1-(1,4-dimethylpyrrolidin-3-yl)pyrrolidin-3-ol
CID 130685458
(3S)-1-cyclopentylpyrrolidin-3-ol
CID 58155463
(1S,5S)-3-azabicyclo[3.2.1]octan-8-ol
CID 98114773
(3R)-1-(2-methyloxolan-3-yl)pyrrolidin-3-ol
CID 127012008
1-pyrrolidin-3-yl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine
CID 82856132
(3R,4R)-4-[(3R)-3-aminopyrrolidin-1-yl]pyrrolidin-3-ol
CID 130905202

Frequently Asked Questions

What is the IUPAC name of 1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol?
The IUPAC name of 1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol (CID 126845063) is 1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol.
What is the SMILES notation for 1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol?
The canonical SMILES for 1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol is OC1CCN(C2CCC3CNCC32)C1.
What is the InChIKey of 1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol?
The InChIKey is ASGHGNPFSGZYME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c14-9-3-4-13(7-9)11-2-1-8-5-12-6-10(8)11/h8-12,14H,1-7H2.
What are the key properties of 1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol?
1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol has a molecular weight of 196.29 g/mol, XLogP of 0.05, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-4-yl)pyrrolidin-3-ol is sourced from PubChem (CID 126845063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).