6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol

C15H28N2O — CID 177319240

IUPAC6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol
SMILESCCC1CCN(CC2(O)CC3(CN(C)C3)C2)CC1
InChIInChI=1S/C15H28N2O/c1-3-13-4-6-17(7-5-13)12-15(18)8-14(9-15)10-16(2)11-14/h13,18H,3-12H2,1-2H3
InChIKeySLZWBEQINHKSHD-UHFFFAOYSA-N
MW252.40 g/mol
LogP1.57
Rot. Bonds3

About 6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol

6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol (PubChem CID 177319240) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol.

Molecular Properties

Compound Name6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol
PubChem CID177319240
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol
SMILESCCC1CCN(CC2(O)CC3(CN(C)C3)C2)CC1
InChIInChI=1S/C15H28N2O/c1-3-13-4-6-17(7-5-13)12-15(18)8-14(9-15)10-16(2)11-14/h13,18H,3-12H2,1-2H3
InChIKeySLZWBEQINHKSHD-UHFFFAOYSA-N
XLogP1.57
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1,4-Dimethylpiperidin-4-yl)methyl]-3-methylazetidin-3-ol;ethane
CID 142327104
6-Methyl-2-(3-methylbutyl)-2-azaspiro[3.3]heptan-6-ol
CID 175620266
6-(2-Piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
CID 177010463
6-[2-(4-Methylpiperidin-1-yl)ethyl]-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
CID 177010810
6-[2-(4-Methylpiperidin-1-yl)ethyl]-2-azaspiro[3.3]heptan-6-ol
CID 177010964
2-Methyl-6-[(4-methylpiperazin-1-yl)methyl]-2-azaspiro[3.3]heptan-6-ol
CID 177319129
Ethane;2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-2-azaspiro[3.3]heptan-6-ol
CID 177319212
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
Ethane;2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-2-azaspiro[3.3]heptan-6-ol
CID 177319458

Frequently Asked Questions

What is the IUPAC name of 6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol?
The IUPAC name of 6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol (CID 177319240) is 6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol.
What is the SMILES notation for 6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol?
The canonical SMILES for 6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol is CCC1CCN(CC2(O)CC3(CN(C)C3)C2)CC1.
What is the InChIKey of 6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol?
The InChIKey is SLZWBEQINHKSHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-3-13-4-6-17(7-5-13)12-15(18)8-14(9-15)10-16(2)11-14/h13,18H,3-12H2,1-2H3.
What are the key properties of 6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol?
6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol has a molecular weight of 252.40 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-ethylpiperidin-1-yl)methyl]-2-methyl-2-azaspiro[3.3]heptan-6-ol is sourced from PubChem (CID 177319240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).