1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol

C25H27NO — CID 576458

IUPAC1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol
SMILESCC1C(c2ccccc2)N(C)C(c2ccccc2)CC1(O)c1ccccc1
InChIInChI=1S/C25H27NO/c1-19-24(21-14-8-4-9-15-21)26(2)23(20-12-6-3-7-13-20)18-25(19,27)22-16-10-5-11-17-22/h3-17,19,23-24,27H,18H2,1-2H3
InChIKeyXXNRZZXPXAFYRJ-UHFFFAOYSA-N
MW357.50 g/mol
LogP5.33
Rot. Bonds3

About 1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol

1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol (PubChem CID 576458) has the molecular formula C25H27NO and a molecular weight of 357.50 g/mol. Its IUPAC name is 1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol.

Molecular Properties

Compound Name1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol
PubChem CID576458
Molecular FormulaC25H27NO
Molecular Weight357.50 g/mol
Exact Mass357.21
IUPAC Name1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol
SMILESCC1C(c2ccccc2)N(C)C(c2ccccc2)CC1(O)c1ccccc1
InChIInChI=1S/C25H27NO/c1-19-24(21-14-8-4-9-15-21)26(2)23(20-12-6-3-7-13-20)18-25(19,27)22-16-10-5-11-17-22/h3-17,19,23-24,27H,18H2,1-2H3
InChIKeyXXNRZZXPXAFYRJ-UHFFFAOYSA-N
XLogP5.33
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.50
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol?
The IUPAC name of 1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol (CID 576458) is 1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol.
What is the SMILES notation for 1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol?
The canonical SMILES for 1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol is CC1C(c2ccccc2)N(C)C(c2ccccc2)CC1(O)c1ccccc1.
What is the InChIKey of 1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol?
The InChIKey is XXNRZZXPXAFYRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27NO/c1-19-24(21-14-8-4-9-15-21)26(2)23(20-12-6-3-7-13-20)18-25(19,27)22-16-10-5-11-17-22/h3-17,19,23-24,27H,18H2,1-2H3.
What are the key properties of 1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol?
1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol has a molecular weight of 357.50 g/mol, XLogP of 5.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-2,4,6-triphenylpiperidin-4-ol is sourced from PubChem (CID 576458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).