(2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol

C8H17NO — CID 55288510

IUPAC(2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol
SMILESC[C@@H]1[C@H](O)C[C@@H](C)N[C@H]1C
InChIInChI=1S/C8H17NO/c1-5-4-8(10)6(2)7(3)9-5/h5-10H,4H2,1-3H3/t5-,6+,7+,8-/m1/s1
InChIKeyFFRRRWKXLRWRKC-VGRMVHKJSA-N
MW143.23 g/mol
LogP0.75
Rot. Bonds

About (2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol

(2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol (PubChem CID 55288510) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol.

Molecular Properties

Compound Name(2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol
PubChem CID55288510
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol
SMILESC[C@@H]1[C@H](O)C[C@@H](C)N[C@H]1C
InChIInChI=1S/C8H17NO/c1-5-4-8(10)6(2)7(3)9-5/h5-10H,4H2,1-3H3/t5-,6+,7+,8-/m1/s1
InChIKeyFFRRRWKXLRWRKC-VGRMVHKJSA-N
XLogP0.75
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol?
The IUPAC name of (2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol (CID 55288510) is (2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol.
What is the SMILES notation for (2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol?
The canonical SMILES for (2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol is C[C@@H]1[C@H](O)C[C@@H](C)N[C@H]1C.
What is the InChIKey of (2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol?
The InChIKey is FFRRRWKXLRWRKC-VGRMVHKJSA-N. The full InChI is InChI=1S/C8H17NO/c1-5-4-8(10)6(2)7(3)9-5/h5-10H,4H2,1-3H3/t5-,6+,7+,8-/m1/s1.
What are the key properties of (2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol?
(2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol has a molecular weight of 143.23 g/mol, XLogP of 0.75, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S,4R,6R)-2,3,6-trimethylpiperidin-4-ol is sourced from PubChem (CID 55288510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).