(2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol

C18H29NO2 — CID 102583972

IUPAC(2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol
SMILESCc1ccc([C@H](CO)ON2C(C)(C)CCCC2(C)C)cc1
InChIInChI=1S/C18H29NO2/c1-14-7-9-15(10-8-14)16(13-20)21-19-17(2,3)11-6-12-18(19,4)5/h7-10,16,20H,6,11-13H2,1-5H3/t16-/m0/s1
InChIKeyPARWYMRNGHLPFA-INIZCTEOSA-N
MW291.44 g/mol
LogP4.00
Rot. Bonds4

About (2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol

(2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol (PubChem CID 102583972) has the molecular formula C18H29NO2 and a molecular weight of 291.44 g/mol. Its IUPAC name is (2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol.

Molecular Properties

Compound Name(2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol
PubChem CID102583972
Molecular FormulaC18H29NO2
Molecular Weight291.44 g/mol
Exact Mass291.22
IUPAC Name(2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol
SMILESCc1ccc([C@H](CO)ON2C(C)(C)CCCC2(C)C)cc1
InChIInChI=1S/C18H29NO2/c1-14-7-9-15(10-8-14)16(13-20)21-19-17(2,3)11-6-12-18(19,4)5/h7-10,16,20H,6,11-13H2,1-5H3/t16-/m0/s1
InChIKeyPARWYMRNGHLPFA-INIZCTEOSA-N
XLogP4.00
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol?
The IUPAC name of (2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol (CID 102583972) is (2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol.
What is the SMILES notation for (2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol?
The canonical SMILES for (2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol is Cc1ccc([C@H](CO)ON2C(C)(C)CCCC2(C)C)cc1.
What is the InChIKey of (2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol?
The InChIKey is PARWYMRNGHLPFA-INIZCTEOSA-N. The full InChI is InChI=1S/C18H29NO2/c1-14-7-9-15(10-8-14)16(13-20)21-19-17(2,3)11-6-12-18(19,4)5/h7-10,16,20H,6,11-13H2,1-5H3/t16-/m0/s1.
What are the key properties of (2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol?
(2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol has a molecular weight of 291.44 g/mol, XLogP of 4.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol is sourced from PubChem (CID 102583972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).