5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride

C13H25ClN2 — CID 120858012

IUPAC5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride
SMILESC1CNCC(CN2CCCC23CCC3)C1.Cl
InChIInChI=1S/C13H24N2.ClH/c1-4-12(10-14-8-1)11-15-9-3-7-13(15)5-2-6-13;/h12,14H,1-11H2;1H
InChIKeyOAJZVURSKLWKBS-UHFFFAOYSA-N
MW244.81 g/mol
LogP2.43
Rot. Bonds2

About 5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride

5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride (PubChem CID 120858012) has the molecular formula C13H25ClN2 and a molecular weight of 244.81 g/mol. Its IUPAC name is 5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride.

Molecular Properties

Compound Name5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride
PubChem CID120858012
Molecular FormulaC13H25ClN2
Molecular Weight244.81 g/mol
Exact Mass244.17
IUPAC Name5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride
SMILESC1CNCC(CN2CCCC23CCC3)C1.Cl
InChIInChI=1S/C13H24N2.ClH/c1-4-12(10-14-8-1)11-15-9-3-7-13(15)5-2-6-13;/h12,14H,1-11H2;1H
InChIKeyOAJZVURSKLWKBS-UHFFFAOYSA-N
XLogP2.43
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.81
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride 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-(cyclopropylmethyl)-1,8-diazaspiro[4.5]decane
CID 83618580
6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane
CID 120855430
[2-ethyl-1-(piperidin-3-ylmethyl)pyrrolidin-2-yl]methanol
CID 120848962
1-(cyclopropylmethyl)-1,9-diazaspiro[4.5]decane
CID 83618588
1-(cyclopropylmethyl)-1,8-diazaspiro[3.5]nonane;dihydrochloride
CID 155854093
[3-fluoro-1-(piperidin-3-ylmethyl)pyrrolidin-3-yl]methanol;hydrochloride
CID 120858328
2-(piperidin-3-ylmethyl)-9-oxa-2-azaspiro[5.5]undecane;hydrochloride
CID 119931803
4-fluoro-4-methyl-1-(piperidin-3-ylmethyl)piperidine
CID 115028862
(3R)-3-[(3,3-difluoropyrrolidin-1-yl)methyl]piperidine
CID 130630857
3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride
CID 120849148
(3R)-1-(piperidin-3-ylmethyl)pyrrolidin-3-ol;hydrochloride
CID 130662876
3-[(3,3-dimethylazetidin-1-yl)methyl]piperidine
CID 79678705

Frequently Asked Questions

What is the IUPAC name of 5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride?
The IUPAC name of 5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride (CID 120858012) is 5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride.
What is the SMILES notation for 5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride?
The canonical SMILES for 5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride is C1CNCC(CN2CCCC23CCC3)C1.Cl.
What is the InChIKey of 5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride?
The InChIKey is OAJZVURSKLWKBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2.ClH/c1-4-12(10-14-8-1)11-15-9-3-7-13(15)5-2-6-13;/h12,14H,1-11H2;1H.
What are the key properties of 5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride?
5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride has a molecular weight of 244.81 g/mol, XLogP of 2.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride is sourced from PubChem (CID 120858012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).