6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol

C14H26N2O — CID 177010964

IUPAC6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol
SMILESCC1CCN(CCC2(O)CC3(CNC3)C2)CC1
InChIInChI=1S/C14H26N2O/c1-12-2-5-16(6-3-12)7-4-14(17)8-13(9-14)10-15-11-13/h12,15,17H,2-11H2,1H3
InChIKeyYFYYVZPUPVYDGM-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.22
Rot. Bonds3

About 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol

6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol (PubChem CID 177010964) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol.

Molecular Properties

Compound Name6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol
PubChem CID177010964
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol
SMILESCC1CCN(CCC2(O)CC3(CNC3)C2)CC1
InChIInChI=1S/C14H26N2O/c1-12-2-5-16(6-3-12)7-4-14(17)8-13(9-14)10-15-11-13/h12,15,17H,2-11H2,1H3
InChIKeyYFYYVZPUPVYDGM-UHFFFAOYSA-N
XLogP1.22
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-Piperidin-4-ylethyl)-2-azaspiro[3.3]heptan-6-ol
CID 171083121
4-(Azetidin-3-ylmethyl)piperidin-4-ol
CID 175286562
6-(2-Piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
CID 177010463
6-[2-(4-Aminopiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
CID 177010618
6-[2-(4-Methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
CID 177010810
6-[2-(4-Propan-2-ylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol
CID 177011023
2-Methyl-6-[(4-methylpiperidin-1-yl)methyl]-2-azaspiro[3.3]heptan-6-ol
CID 177319298
4-(1-Amino-2-methylbutan-2-yl)-1-(2-methylpropyl)piperidin-4-ol
CID 108416320
4-[1-(Aminomethyl)cyclobutyl]-1-(2-methylpropyl)piperidin-4-ol
CID 108416335
4-(Azetidin-3-yl)-1,2-dimethylpiperidin-4-ol
CID 126976848
6-[2-(4-Butan-2-ylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol
CID 177010546
6-[(4-Ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol
CID 177319240

Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol?
The IUPAC name of 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol (CID 177010964) is 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol.
What is the SMILES notation for 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol?
The canonical SMILES for 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol is CC1CCN(CCC2(O)CC3(CNC3)C2)CC1.
What is the InChIKey of 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol?
The InChIKey is YFYYVZPUPVYDGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-12-2-5-16(6-3-12)7-4-14(17)8-13(9-14)10-15-11-13/h12,15,17H,2-11H2,1H3.
What are the key properties of 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol?
6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol has a molecular weight of 238.37 g/mol, XLogP of 1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol is sourced from PubChem (CID 177010964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).