(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate

C19H29NO4 — CID 88974835

IUPAC(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate
SMILESCON1C(C)(C)CC(OC(=O)OCc2ccc(C)cc2)CC1(C)C
InChIInChI=1S/C19H29NO4/c1-14-7-9-15(10-8-14)13-23-17(21)24-16-11-18(2,3)20(22-6)19(4,5)12-16/h7-10,16H,11-13H2,1-6H3
InChIKeyPEKLYIALWRPBMS-UHFFFAOYSA-N
MW335.44 g/mol
LogP4.23
Rot. Bonds4

About (1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate

(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate (PubChem CID 88974835) has the molecular formula C19H29NO4 and a molecular weight of 335.44 g/mol. Its IUPAC name is (1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate.

Molecular Properties

Compound Name(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate
PubChem CID88974835
Molecular FormulaC19H29NO4
Molecular Weight335.44 g/mol
Exact Mass335.21
IUPAC Name(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate
SMILESCON1C(C)(C)CC(OC(=O)OCc2ccc(C)cc2)CC1(C)C
InChIInChI=1S/C19H29NO4/c1-14-7-9-15(10-8-14)13-23-17(21)24-16-11-18(2,3)20(22-6)19(4,5)12-16/h7-10,16H,11-13H2,1-6H3
InChIKeyPEKLYIALWRPBMS-UHFFFAOYSA-N
XLogP4.23
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.44
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate?
The IUPAC name of (1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate (CID 88974835) is (1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate.
What is the SMILES notation for (1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate?
The canonical SMILES for (1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate is CON1C(C)(C)CC(OC(=O)OCc2ccc(C)cc2)CC1(C)C.
What is the InChIKey of (1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate?
The InChIKey is PEKLYIALWRPBMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO4/c1-14-7-9-15(10-8-14)13-23-17(21)24-16-11-18(2,3)20(22-6)19(4,5)12-16/h7-10,16H,11-13H2,1-6H3.
What are the key properties of (1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate?
(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate has a molecular weight of 335.44 g/mol, XLogP of 4.23, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) (4-methylphenyl)methyl carbonate is sourced from PubChem (CID 88974835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).