N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide

C20H32N2O4 — CID 3382077

IUPACN-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(OCC(O)CN2C(C)(C)CC(O)CC2(C)C)cc1
InChIInChI=1S/C20H32N2O4/c1-14(23)21-15-6-8-18(9-7-15)26-13-17(25)12-22-19(2,3)10-16(24)11-20(22,4)5/h6-9,16-17,24-25H,10-13H2,1-5H3,(H,21,23)
InChIKeyBNXNUWJEUXXUCR-UHFFFAOYSA-N
MW364.49 g/mol
LogP2.40
Rot. Bonds6

About N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide

N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide (PubChem CID 3382077) has the molecular formula C20H32N2O4 and a molecular weight of 364.49 g/mol. Its IUPAC name is N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide
PubChem CID3382077
Molecular FormulaC20H32N2O4
Molecular Weight364.49 g/mol
Exact Mass364.24
IUPAC NameN-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(OCC(O)CN2C(C)(C)CC(O)CC2(C)C)cc1
InChIInChI=1S/C20H32N2O4/c1-14(23)21-15-6-8-18(9-7-15)26-13-17(25)12-22-19(2,3)10-16(24)11-20(22,4)5/h6-9,16-17,24-25H,10-13H2,1-5H3,(H,21,23)
InChIKeyBNXNUWJEUXXUCR-UHFFFAOYSA-N
XLogP2.40
TPSA82.03 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 52.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide?
The IUPAC name of N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide (CID 3382077) is N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide.
What is the SMILES notation for N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide?
The canonical SMILES for N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide is CC(=O)Nc1ccc(OCC(O)CN2C(C)(C)CC(O)CC2(C)C)cc1.
What is the InChIKey of N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide?
The InChIKey is BNXNUWJEUXXUCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O4/c1-14(23)21-15-6-8-18(9-7-15)26-13-17(25)12-22-19(2,3)10-16(24)11-20(22,4)5/h6-9,16-17,24-25H,10-13H2,1-5H3,(H,21,23).
What are the key properties of N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide?
N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide has a molecular weight of 364.49 g/mol, XLogP of 2.40, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-hydroxy-3-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)propoxy]phenyl]acetamide is sourced from PubChem (CID 3382077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).