6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane

C13H24N2O2 — CID 120855430

IUPAC6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane
SMILESC1CNCC(CN2CCOCC23CCOC3)C1
InChIInChI=1S/C13H24N2O2/c1-2-12(8-14-4-1)9-15-5-7-17-11-13(15)3-6-16-10-13/h12,14H,1-11H2
InChIKeyPNOKSHCQPATTPE-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.48
Rot. Bonds2

About 6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane

6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane (PubChem CID 120855430) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane.

Molecular Properties

Compound Name6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane
PubChem CID120855430
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane
SMILESC1CNCC(CN2CCOCC23CCOC3)C1
InChIInChI=1S/C13H24N2O2/c1-2-12(8-14-4-1)9-15-5-7-17-11-13(15)3-6-16-10-13/h12,14H,1-11H2
InChIKeyPNOKSHCQPATTPE-UHFFFAOYSA-N
XLogP0.48
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride
CID 120849148
5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride
CID 120858012
9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane
CID 120856412
2-(piperidin-3-ylmethyl)-7-oxa-2-azaspiro[3.5]nonane
CID 79677882
2-(piperidin-3-ylmethyl)-9-oxa-2-azaspiro[5.5]undecane;hydrochloride
CID 119931803
3-methyl-4-(piperidin-3-ylmethyl)morpholine
CID 43542278
4-(piperidin-3-ylmethyl)-9-oxa-1-thia-4-azaspiro[5.5]undecane;hydrochloride
CID 120856747
8-(piperidin-3-ylmethyl)-3,4,6,7,9,9a-hexahydro-1H-pyrazino[2,1-c][1,4]oxazine;hydrochloride
CID 120848758
[2-ethyl-1-(piperidin-3-ylmethyl)pyrrolidin-2-yl]methanol
CID 120848962
4-(cyclobutylmethyl)-3,3-dimethylmorpholine
CID 127377423
2-methyl-5-[(1-methylpiperidin-4-yl)methyl]-8-oxa-5-azaspiro[3.5]nonane
CID 167009656
3-[2-(oxan-4-yl)ethyl]piperidine;hydrochloride
CID 126845728

Frequently Asked Questions

What is the IUPAC name of 6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane?
The IUPAC name of 6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane (CID 120855430) is 6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane.
What is the SMILES notation for 6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane?
The canonical SMILES for 6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane is C1CNCC(CN2CCOCC23CCOC3)C1.
What is the InChIKey of 6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane?
The InChIKey is PNOKSHCQPATTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-2-12(8-14-4-1)9-15-5-7-17-11-13(15)3-6-16-10-13/h12,14H,1-11H2.
What are the key properties of 6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane?
6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane has a molecular weight of 240.35 g/mol, XLogP of 0.48, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane is sourced from PubChem (CID 120855430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).