6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol

C16H30N2O — CID 177010463

IUPAC6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
SMILESCC(C)N1CC2(C1)CC(O)(CCN1CCCCC1)C2
InChIInChI=1S/C16H30N2O/c1-14(2)18-12-15(13-18)10-16(19,11-15)6-9-17-7-4-3-5-8-17/h14,19H,3-13H2,1-2H3
InChIKeyNNNHBTWGKUHZKZ-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.10
Rot. Bonds4

About 6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol

6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol (PubChem CID 177010463) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol.

Molecular Properties

Compound Name6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
PubChem CID177010463
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol
SMILESCC(C)N1CC2(C1)CC(O)(CCN1CCCCC1)C2
InChIInChI=1S/C16H30N2O/c1-14(2)18-12-15(13-18)10-16(19,11-15)6-9-17-7-4-3-5-8-17/h14,19H,3-13H2,1-2H3
InChIKeyNNNHBTWGKUHZKZ-UHFFFAOYSA-N
XLogP2.10
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol?
The IUPAC name of 6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol (CID 177010463) is 6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol.
What is the SMILES notation for 6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol?
The canonical SMILES for 6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol is CC(C)N1CC2(C1)CC(O)(CCN1CCCCC1)C2.
What is the InChIKey of 6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol?
The InChIKey is NNNHBTWGKUHZKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-14(2)18-12-15(13-18)10-16(19,11-15)6-9-17-7-4-3-5-8-17/h14,19H,3-13H2,1-2H3.
What are the key properties of 6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol?
6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol has a molecular weight of 266.43 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-piperidin-1-ylethyl)-2-propan-2-yl-2-azaspiro[3.3]heptan-6-ol is sourced from PubChem (CID 177010463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).