9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane

C14H26N2O — CID 120856412

IUPAC9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane
SMILESC1CNCC(CN2CCOCC3(CCC3)C2)C1
InChIInChI=1S/C14H26N2O/c1-3-13(9-15-6-1)10-16-7-8-17-12-14(11-16)4-2-5-14/h13,15H,1-12H2
InChIKeyKSTGIVQOWBEKKU-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.49
Rot. Bonds2

About 9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane

9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane (PubChem CID 120856412) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane.

Molecular Properties

Compound Name9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane
PubChem CID120856412
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane
SMILESC1CNCC(CN2CCOCC3(CCC3)C2)C1
InChIInChI=1S/C14H26N2O/c1-3-13(9-15-6-1)10-16-7-8-17-12-14(11-16)4-2-5-14/h13,15H,1-12H2
InChIKeyKSTGIVQOWBEKKU-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(piperidin-3-ylmethyl)-9-oxa-2-azaspiro[5.5]undecane;hydrochloride
CID 119931803
2-(piperidin-3-ylmethyl)-7-oxa-2-azaspiro[3.5]nonane
CID 79677882
6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane
CID 120855430
(3R)-3-[(3,3-difluoropyrrolidin-1-yl)methyl]piperidine
CID 130630857
4-(piperidin-3-ylmethyl)-9-oxa-1-thia-4-azaspiro[5.5]undecane;hydrochloride
CID 120856747
3,3-difluoro-4-methyl-1-(piperidin-3-ylmethyl)piperidine
CID 120849326
3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride
CID 120849148
3-[(3,3-dimethylazetidin-1-yl)methyl]piperidine
CID 79678705
[3-fluoro-1-(piperidin-3-ylmethyl)pyrrolidin-3-yl]methanol;hydrochloride
CID 120858328
4-fluoro-4-methyl-1-(piperidin-3-ylmethyl)piperidine
CID 115028862
2-(cyclobutylmethyl)-2,8-diazaspiro[5.5]undecane
CID 102849456
3-[[3-(oxan-4-yl)pyrrolidin-1-yl]methyl]piperidine
CID 120849762

Frequently Asked Questions

What is the IUPAC name of 9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane?
The IUPAC name of 9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane (CID 120856412) is 9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane.
What is the SMILES notation for 9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane?
The canonical SMILES for 9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane is C1CNCC(CN2CCOCC3(CCC3)C2)C1.
What is the InChIKey of 9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane?
The InChIKey is KSTGIVQOWBEKKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-3-13(9-15-6-1)10-16-7-8-17-12-14(11-16)4-2-5-14/h13,15H,1-12H2.
What are the key properties of 9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane?
9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane has a molecular weight of 238.37 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane is sourced from PubChem (CID 120856412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).