2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine

C17H26N2O2 — CID 91502421

IUPAC2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine
SMILESCC(ON1C(C)(C)CC(N=O)CC1(C)C)c1ccccc1
InChIInChI=1S/C17H26N2O2/c1-13(14-9-7-6-8-10-14)21-19-16(2,3)11-15(18-20)12-17(19,4)5/h6-10,13,15H,11-12H2,1-5H3
InChIKeyCWCPTHWGZKIING-UHFFFAOYSA-N
MW290.41 g/mol
LogP4.47
Rot. Bonds4

About 2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine

2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine (PubChem CID 91502421) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine
PubChem CID91502421
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine
SMILESCC(ON1C(C)(C)CC(N=O)CC1(C)C)c1ccccc1
InChIInChI=1S/C17H26N2O2/c1-13(14-9-7-6-8-10-14)21-19-16(2,3)11-15(18-20)12-17(19,4)5/h6-10,13,15H,11-12H2,1-5H3
InChIKeyCWCPTHWGZKIING-UHFFFAOYSA-N
XLogP4.47
TPSA41.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

tris[2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-yl] phosphite
CID 54125950
4-ethoxy-2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidine
CID 89097657
4-[2,2-diethyl-6,6-dimethyl-1-(1-phenylethoxy)piperidin-4-yl]imino-4-methoxybutanoic acid
CID 69413435
2,2-diethyl-6,6-dimethyl-1-(1-phenylethoxy)piperidin-4-amine
CID 21361325
2-ethyl-2,6,6-trimethyl-1-(1-phenylethoxy)piperidin-4-amine
CID 69411966
[2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-yl] naphthalene-1-carboxylate
CID 101204019
1,4-dimethoxy-2,2,6,6-tetramethylpiperidine;(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) benzoate;[2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-yl] benzoate
CID 158307203
N-[2,2-diethyl-6,6-dimethyl-1-(1-phenylethoxy)piperidin-4-yl]formamide
CID 22992797
4-[3,5-bis[[2,2,6-trimethyl-1-(1-phenylethoxy)-6-propan-2-ylpiperidin-4-yl]oxy]phenoxy]-2,2,6-trimethyl-1-(1-phenylethoxy)-6-propan-2-ylpiperidine
CID 121244701
2,2,5-trimethyl-5-phenyl-1-(1-phenylethoxy)pyrrolidine
CID 71391438
2,2-diethyl-6,6-dimethyl-4-octadecyl-1-(1-phenylethoxy)piperidine
CID 174431842
formic acid;3,3,8,8,10,10-hexamethyl-9-(1-phenylethoxy)-1,5-dioxa-9-azaspiro[5.5]undecane
CID 142146379

Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine?
The IUPAC name of 2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine (CID 91502421) is 2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine.
What is the SMILES notation for 2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine?
The canonical SMILES for 2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine is CC(ON1C(C)(C)CC(N=O)CC1(C)C)c1ccccc1.
What is the InChIKey of 2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine?
The InChIKey is CWCPTHWGZKIING-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13(14-9-7-6-8-10-14)21-19-16(2,3)11-15(18-20)12-17(19,4)5/h6-10,13,15H,11-12H2,1-5H3.
What are the key properties of 2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine?
2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine has a molecular weight of 290.41 g/mol, XLogP of 4.47, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-4-nitroso-1-(1-phenylethoxy)piperidine is sourced from PubChem (CID 91502421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).