(3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol

C11H22N2O — CID 86323422

IUPAC(3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol
SMILESO[C@H]1CCN(CC[C@@H]2CCCNC2)C1
InChIInChI=1S/C11H22N2O/c14-11-4-7-13(9-11)6-3-10-2-1-5-12-8-10/h10-12,14H,1-9H2/t10-,11-/m0/s1
InChIKeyITCKZTXYVNOKOQ-QWRGUYRKSA-N
MW198.31 g/mol
LogP0.44
Rot. Bonds3

About (3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol

(3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol (PubChem CID 86323422) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol.

Molecular Properties

Compound Name(3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol
PubChem CID86323422
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol
SMILESO[C@H]1CCN(CC[C@@H]2CCCNC2)C1
InChIInChI=1S/C11H22N2O/c14-11-4-7-13(9-11)6-3-10-2-1-5-12-8-10/h10-12,14H,1-9H2/t10-,11-/m0/s1
InChIKeyITCKZTXYVNOKOQ-QWRGUYRKSA-N
XLogP0.44
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-piperidin-3-ylethyl)piperidin-4-ol;dihydrochloride
CID 56831674
(3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride
CID 130662876
2-[4-(2-piperidin-3-ylethyl)piperazin-1-yl]ethanol
CID 53408974
1-(2-piperidin-3-ylethyl)piperidine-3-carboxamide
CID 55064960
1-(2-piperidin-4-ylethyl)piperidin-3-ol
CID 83821198
4-methyl-1-(2-piperidin-3-ylethyl)azepane
CID 63622050
2-(2-piperidin-3-ylethyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79932356
1-cyclopentyl-4-(2-piperidin-3-ylethyl)piperazine
CID 55091230
4-(2-piperidin-3-ylethyl)-1,4-thiazinane 1,1-dioxide
CID 62356507
1-methyl-4-(2-piperidin-3-ylethyl)-1,4-diazepane
CID 62357709
3-(2-piperidin-3-ylethyl)-3-azaspiro[5.5]undecane
CID 62937065
N-[[1-(2-piperidin-3-ylethyl)piperidin-4-yl]methyl]acetamide
CID 102736376

Frequently Asked Questions

What is the IUPAC name of (3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol?
The IUPAC name of (3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol (CID 86323422) is (3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol.
What is the SMILES notation for (3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol?
The canonical SMILES for (3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol is O[C@H]1CCN(CC[C@@H]2CCCNC2)C1.
What is the InChIKey of (3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol?
The InChIKey is ITCKZTXYVNOKOQ-QWRGUYRKSA-N. The full InChI is InChI=1S/C11H22N2O/c14-11-4-7-13(9-11)6-3-10-2-1-5-12-8-10/h10-12,14H,1-9H2/t10-,11-/m0/s1.
What are the key properties of (3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol?
(3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol has a molecular weight of 198.31 g/mol, XLogP of 0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol is sourced from PubChem (CID 86323422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).