1,4,4,5,5,6,6-heptamethylpiperidin-2-ol

C12H25NO — CID 134324510

IUPAC1,4,4,5,5,6,6-heptamethylpiperidin-2-ol
SMILESCN1C(O)CC(C)(C)C(C)(C)C1(C)C
InChIInChI=1S/C12H25NO/c1-10(2)8-9(14)13(7)12(5,6)11(10,3)4/h9,14H,8H2,1-7H3
InChIKeyHPFIRGIUYWZCEL-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.47
Rot. Bonds

About 1,4,4,5,5,6,6-heptamethylpiperidin-2-ol

1,4,4,5,5,6,6-heptamethylpiperidin-2-ol (PubChem CID 134324510) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 1,4,4,5,5,6,6-heptamethylpiperidin-2-ol.

Molecular Properties

Compound Name1,4,4,5,5,6,6-heptamethylpiperidin-2-ol
PubChem CID134324510
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name1,4,4,5,5,6,6-heptamethylpiperidin-2-ol
SMILESCN1C(O)CC(C)(C)C(C)(C)C1(C)C
InChIInChI=1S/C12H25NO/c1-10(2)8-9(14)13(7)12(5,6)11(10,3)4/h9,14H,8H2,1-7H3
InChIKeyHPFIRGIUYWZCEL-UHFFFAOYSA-N
XLogP2.47
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,4,4,5,5,6,6-heptamethylpiperidin-2-ol?
The IUPAC name of 1,4,4,5,5,6,6-heptamethylpiperidin-2-ol (CID 134324510) is 1,4,4,5,5,6,6-heptamethylpiperidin-2-ol.
What is the SMILES notation for 1,4,4,5,5,6,6-heptamethylpiperidin-2-ol?
The canonical SMILES for 1,4,4,5,5,6,6-heptamethylpiperidin-2-ol is CN1C(O)CC(C)(C)C(C)(C)C1(C)C.
What is the InChIKey of 1,4,4,5,5,6,6-heptamethylpiperidin-2-ol?
The InChIKey is HPFIRGIUYWZCEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-10(2)8-9(14)13(7)12(5,6)11(10,3)4/h9,14H,8H2,1-7H3.
What are the key properties of 1,4,4,5,5,6,6-heptamethylpiperidin-2-ol?
1,4,4,5,5,6,6-heptamethylpiperidin-2-ol has a molecular weight of 199.34 g/mol, XLogP of 2.47, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,4,5,5,6,6-heptamethylpiperidin-2-ol is sourced from PubChem (CID 134324510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).