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

C17H32N2O — CID 177010810

IUPAC6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
SMILESCC1CCN(CCC2(O)CC3(CN(C(C)C)C3)C2)CC1
InChIInChI=1S/C17H32N2O/c1-14(2)19-12-16(13-19)10-17(20,11-16)6-9-18-7-4-15(3)5-8-18/h14-15,20H,4-13H2,1-3H3
InChIKeyIYKBCVGTSJKFFM-UHFFFAOYSA-N
MW280.46 g/mol
LogP2.34
Rot. Bonds4

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

6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol (PubChem CID 177010810) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol.

Molecular Properties

Compound Name6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
PubChem CID177010810
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
SMILESCC1CCN(CCC2(O)CC3(CN(C(C)C)C3)C2)CC1
InChIInChI=1S/C17H32N2O/c1-14(2)19-12-16(13-19)10-17(20,11-16)6-9-18-7-4-15(3)5-8-18/h14-15,20H,4-13H2,1-3H3
InChIKeyIYKBCVGTSJKFFM-UHFFFAOYSA-N
XLogP2.34
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

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Related Compounds

3-(3-Tert-butylpiperidin-1-yl)-1-methylcyclobutan-1-ol
CID 176585106
6-Ethyl-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
CID 176643582
Ethane;1-methyl-3-[3-(1-methylazetidin-3-yl)piperidin-1-yl]cyclobutan-1-ol
CID 176978995
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-azaspiro[3.3]heptan-6-ol
CID 177010964
6-[2-(4-Propan-2-ylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol
CID 177011023
Ethane;6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol
CID 177319239
Ethane;2-methyl-6-[(4-methylpiperidin-1-yl)methyl]-2-azaspiro[3.3]heptan-6-ol
CID 177319297
2-Methyl-6-[(4-methylpiperidin-1-yl)methyl]-2-azaspiro[3.3]heptan-6-ol
CID 177319298
Ethane;2-methyl-6-[(4-methylpiperidin-1-yl)methyl]-2-azaspiro[3.3]heptan-6-ol
CID 177319368
1-Methyl-3-[3-(1-methylazetidin-3-yl)piperidin-1-yl]cyclobutan-1-ol
CID 176978996

Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol?
The IUPAC name of 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol (CID 177010810) is 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol.
What is the SMILES notation for 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol?
The canonical SMILES for 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol is CC1CCN(CCC2(O)CC3(CN(C(C)C)C3)C2)CC1.
What is the InChIKey of 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol?
The InChIKey is IYKBCVGTSJKFFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-14(2)19-12-16(13-19)10-17(20,11-16)6-9-18-7-4-15(3)5-8-18/h14-15,20H,4-13H2,1-3H3.
What are the key properties of 6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol?
6-[2-(4-methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol has a molecular weight of 280.46 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 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-propan-2-yl-2-azaspiro[3.3]heptan-6-ol is sourced from PubChem (CID 177010810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).