1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide

C37H75N5O6 — CID 158908289

IUPAC1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide
SMILESCC1(C)CC(O)CC(C)(C)N1OC1CC1.CCON1C(C)(C)CC(NC(C)=O)CC1(C)C.CN(C)CON1C(C)(C)CC(O)CC1(C)C
InChIInChI=1S/C13H26N2O2.C12H26N2O2.C12H23NO2/c1-7-17-15-12(3,4)8-11(14-10(2)16)9-13(15,5)6;1-11(2)7-10(15)8-12(3,4)14(11)16-9-13(5)6;1-11(2)7-9(14)8-12(3,4)13(11)15-10-5-6-10/h11H,7-9H2,1-6H3,(H,14,16);10,15H,7-9H2,1-6H3;9-10,14H,5-8H2,1-4H3
InChIKeyJGIAMDWEXQZIFJ-UHFFFAOYSA-N
MW686.04 g/mol
LogP5.64
Rot. Bonds8

About 1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide

1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide (PubChem CID 158908289) has the molecular formula C37H75N5O6 and a molecular weight of 686.04 g/mol. Its IUPAC name is 1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide.

Molecular Properties

Compound Name1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide
PubChem CID158908289
Molecular FormulaC37H75N5O6
Molecular Weight686.04 g/mol
Exact Mass685.57
IUPAC Name1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide
SMILESCC1(C)CC(O)CC(C)(C)N1OC1CC1.CCON1C(C)(C)CC(NC(C)=O)CC1(C)C.CN(C)CON1C(C)(C)CC(O)CC1(C)C
InChIInChI=1S/C13H26N2O2.C12H26N2O2.C12H23NO2/c1-7-17-15-12(3,4)8-11(14-10(2)16)9-13(15,5)6;1-11(2)7-10(15)8-12(3,4)14(11)16-9-13(5)6;1-11(2)7-9(14)8-12(3,4)13(11)15-10-5-6-10/h11H,7-9H2,1-6H3,(H,14,16);10,15H,7-9H2,1-6H3;9-10,14H,5-8H2,1-4H3
InChIKeyJGIAMDWEXQZIFJ-UHFFFAOYSA-N
XLogP5.64
TPSA110.21 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500686.04
LogP ≤ 55.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide with MolForge

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Related Compounds

1-ethoxy-2,2,4,6,6-pentamethylpiperidine;1-ethoxy-2,2,6,6-tetramethylpiperidin-4-ol;methane
CID 161023393
N-[2,2,6,6-tetramethyl-1-(2-methylidenecyclohexyl)oxypiperidin-4-yl]acetamide
CID 101428219
N-(2,2,6,6-tetramethyl-1-phenylmethoxypiperidin-4-yl)acetamide
CID 102049531
(4-acetamido-2,2,6,6-tetramethylpiperidin-1-yl)oxyazanium tetrafluoroborate
CID 141471658
bis(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate
CID 141285453
2,2,6,6-tetramethyl-1-octoxypiperidin-4-ol
CID 11346683
2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol
CID 23159798
but-2-enedioic acid;bis((1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl) acetate)
CID 173111319
1-butan-2-yloxy-2,2,6,6-tetramethylpiperidin-4-ol
CID 88999908
ethane;1-hexoxy-2,2,6,6-tetramethylpiperidin-4-ol
CID 143602726
N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide
CID 91804541
1-[2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxycyclohexyl]oxy-2,2,6,6-tetramethylpiperidin-4-ol
CID 101197043

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The IUPAC name of 1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide (CID 158908289) is 1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide.
What is the SMILES notation for 1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The canonical SMILES for 1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide is CC1(C)CC(O)CC(C)(C)N1OC1CC1.CCON1C(C)(C)CC(NC(C)=O)CC1(C)C.CN(C)CON1C(C)(C)CC(O)CC1(C)C.
What is the InChIKey of 1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The InChIKey is JGIAMDWEXQZIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2.C12H26N2O2.C12H23NO2/c1-7-17-15-12(3,4)8-11(14-10(2)16)9-13(15,5)6;1-11(2)7-10(15)8-12(3,4)14(11)16-9-13(5)6;1-11(2)7-9(14)8-12(3,4)13(11)15-10-5-6-10/h11H,7-9H2,1-6H3,(H,14,16);10,15H,7-9H2,1-6H3;9-10,14H,5-8H2,1-4H3.
What are the key properties of 1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide has a molecular weight of 686.04 g/mol, XLogP of 5.64, 8 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyloxy-2,2,6,6-tetramethylpiperidin-4-ol;1-[(dimethylamino)methoxy]-2,2,6,6-tetramethylpiperidin-4-ol;N-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl)acetamide is sourced from PubChem (CID 158908289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).