(3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride

C10H21ClN2O — CID 130662876

IUPAC(3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride
SMILESCl.O[C@@H]1CCN(CC2CCCNC2)C1
InChIInChI=1S/C10H20N2O.ClH/c13-10-3-5-12(8-10)7-9-2-1-4-11-6-9;/h9-11,13H,1-8H2;1H/t9?,10-;/m1./s1
InChIKeySJJXJYDLJXHWOJ-FJYJDOHQSA-N
MW220.74 g/mol
LogP0.47
Rot. Bonds2

About (3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride

(3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride (PubChem CID 130662876) has the molecular formula C10H21ClN2O and a molecular weight of 220.74 g/mol. Its IUPAC name is (3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride.

Molecular Properties

Compound Name(3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride
PubChem CID130662876
Molecular FormulaC10H21ClN2O
Molecular Weight220.74 g/mol
Exact Mass220.13
IUPAC Name(3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride
SMILESCl.O[C@@H]1CCN(CC2CCCNC2)C1
InChIInChI=1S/C10H20N2O.ClH/c13-10-3-5-12(8-10)7-9-2-1-4-11-6-9;/h9-11,13H,1-8H2;1H/t9?,10-;/m1./s1
InChIKeySJJXJYDLJXHWOJ-FJYJDOHQSA-N
XLogP0.47
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.74
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-1-[2-[(3S)-piperidin-3-yl]ethyl]pyrrolidin-3-ol
CID 86323422
3-methyl-1-(piperidin-3-ylmethyl)piperidin-4-ol;hydrochloride
CID 120848616
1-(cyclopentylmethyl)pyrrolidin-3-ol
CID 62916815
1-[[(3R)-pyrrolidin-3-yl]methyl]piperidin-4-ol
CID 86323550
(3R)-1-(piperidin-4-ylmethyl)pyrrolidin-3-ol
CID 86323280
1-(2-piperidin-3-ylethyl)piperidin-4-ol;dihydrochloride
CID 56831674
[1-(piperidin-3-ylmethyl)piperidin-4-yl]methanol
CID 80554337
3-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]piperidine
CID 63169624
(3S)-3-methyl-1-[[(3S)-piperidin-3-yl]methyl]piperidine
CID 124802901
3,3-dimethyl-1-(piperidin-3-ylmethyl)piperidin-4-ol
CID 120848601
3-[[3-(oxan-4-yl)pyrrolidin-1-yl]methyl]piperidine
CID 120849762
1-cyclopropyl-3-[1-(piperidin-3-ylmethyl)pyrrolidin-3-yl]urea
CID 120849812

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride?
The IUPAC name of (3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride (CID 130662876) is (3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride.
What is the SMILES notation for (3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride?
The canonical SMILES for (3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride is Cl.O[C@@H]1CCN(CC2CCCNC2)C1.
What is the InChIKey of (3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride?
The InChIKey is SJJXJYDLJXHWOJ-FJYJDOHQSA-N. The full InChI is InChI=1S/C10H20N2O.ClH/c13-10-3-5-12(8-10)7-9-2-1-4-11-6-9;/h9-11,13H,1-8H2;1H/t9?,10-;/m1./s1.
What are the key properties of (3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride?
(3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride has a molecular weight of 220.74 g/mol, XLogP of 0.47, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride is sourced from PubChem (CID 130662876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).