2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol

C21H27NO — CID 14810514

IUPAC2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol
SMILESCC1CCCC(C)N1CC(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H27NO/c1-17-10-9-11-18(2)22(17)16-21(23,19-12-5-3-6-13-19)20-14-7-4-8-15-20/h3-8,12-15,17-18,23H,9-11,16H2,1-2H3
InChIKeyNDRYSTVDBKVIRV-UHFFFAOYSA-N
MW309.45 g/mol
LogP4.19
Rot. Bonds4

About 2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol

2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol (PubChem CID 14810514) has the molecular formula C21H27NO and a molecular weight of 309.45 g/mol. Its IUPAC name is 2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol.

Molecular Properties

Compound Name2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol
PubChem CID14810514
Molecular FormulaC21H27NO
Molecular Weight309.45 g/mol
Exact Mass309.21
IUPAC Name2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol
SMILESCC1CCCC(C)N1CC(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H27NO/c1-17-10-9-11-18(2)22(17)16-21(23,19-12-5-3-6-13-19)20-14-7-4-8-15-20/h3-8,12-15,17-18,23H,9-11,16H2,1-2H3
InChIKeyNDRYSTVDBKVIRV-UHFFFAOYSA-N
XLogP4.19
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.45
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol?
The IUPAC name of 2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol (CID 14810514) is 2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol.
What is the SMILES notation for 2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol?
The canonical SMILES for 2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol is CC1CCCC(C)N1CC(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol?
The InChIKey is NDRYSTVDBKVIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NO/c1-17-10-9-11-18(2)22(17)16-21(23,19-12-5-3-6-13-19)20-14-7-4-8-15-20/h3-8,12-15,17-18,23H,9-11,16H2,1-2H3.
What are the key properties of 2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol?
2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol has a molecular weight of 309.45 g/mol, XLogP of 4.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylethanol is sourced from PubChem (CID 14810514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).