(2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate

C18H36N2O2 — CID 166023714

IUPAC(2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate
SMILESCCCCC(CC)CNC(=O)ON1C(C)(C)CCCC1(C)C
InChIInChI=1S/C18H36N2O2/c1-7-9-11-15(8-2)14-19-16(21)22-20-17(3,4)12-10-13-18(20,5)6/h15H,7-14H2,1-6H3,(H,19,21)
InChIKeyAWAKBDLKHHONGI-UHFFFAOYSA-N
MW312.50 g/mol
LogP4.89
Rot. Bonds7

About (2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate

(2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate (PubChem CID 166023714) has the molecular formula C18H36N2O2 and a molecular weight of 312.50 g/mol. Its IUPAC name is (2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate.

Molecular Properties

Compound Name(2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate
PubChem CID166023714
Molecular FormulaC18H36N2O2
Molecular Weight312.50 g/mol
Exact Mass312.28
IUPAC Name(2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate
SMILESCCCCC(CC)CNC(=O)ON1C(C)(C)CCCC1(C)C
InChIInChI=1S/C18H36N2O2/c1-7-9-11-15(8-2)14-19-16(21)22-20-17(3,4)12-10-13-18(20,5)6/h15H,7-14H2,1-6H3,(H,19,21)
InChIKeyAWAKBDLKHHONGI-UHFFFAOYSA-N
XLogP4.89
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.50
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2,2,6,6-tetramethylpiperidin-1-yl) N-hexylcarbamate
CID 141397797
sodium;2-ethylhexyl N-(2-ethylhexyl)carbamate;hydride
CID 175143259
N-[(2R)-2-ethylhexyl]pyrrolidine-1-carboxamide
CID 95571619
N-(2-ethylhexyl)acetamide;fluoromethane
CID 145149425
(2,2,6,6-tetramethylpiperidin-1-yl) N-methylcarbamate
CID 167207080
1-(2-ethylhexylcarbamoyl)cyclopropane-1-carboxylic acid
CID 103941259
N-(2-ethylhexyl)-2-[1-(sulfanylmethyl)cyclopropyl]acetamide
CID 107818575
(2S)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyhexanal
CID 102135644
1-(2-ethylhexyl)-3-propan-2-ylurea
CID 78858171
1-(2-ethylhexylcarbamoylamino)cyclopropane-1-carboxylic acid
CID 113363228
(2-ethylhexylamino)carbamic acid
CID 151602670
4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxycarbonylamino]butyl benzoate
CID 57269165

Frequently Asked Questions

What is the IUPAC name of (2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate?
The IUPAC name of (2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate (CID 166023714) is (2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate.
What is the SMILES notation for (2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate?
The canonical SMILES for (2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate is CCCCC(CC)CNC(=O)ON1C(C)(C)CCCC1(C)C.
What is the InChIKey of (2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate?
The InChIKey is AWAKBDLKHHONGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O2/c1-7-9-11-15(8-2)14-19-16(21)22-20-17(3,4)12-10-13-18(20,5)6/h15H,7-14H2,1-6H3,(H,19,21).
What are the key properties of (2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate?
(2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate has a molecular weight of 312.50 g/mol, XLogP of 4.89, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate is sourced from PubChem (CID 166023714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).