(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride

C13H24ClNO3 — CID 11482818

IUPAC(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride
SMILESCC1(C)CC(OC(=O)C2CC2)CC(C)(C)N1O.Cl
InChIInChI=1S/C13H23NO3.ClH/c1-12(2)7-10(8-13(3,4)14(12)16)17-11(15)9-5-6-9;/h9-10,16H,5-8H2,1-4H3;1H
InChIKeyBGEXDXBTNACMOP-UHFFFAOYSA-N
MW277.79 g/mol
LogP2.77
Rot. Bonds2

About (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride

(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride (PubChem CID 11482818) has the molecular formula C13H24ClNO3 and a molecular weight of 277.79 g/mol. Its IUPAC name is (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride.

Molecular Properties

Compound Name(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride
PubChem CID11482818
Molecular FormulaC13H24ClNO3
Molecular Weight277.79 g/mol
Exact Mass277.14
IUPAC Name(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride
SMILESCC1(C)CC(OC(=O)C2CC2)CC(C)(C)N1O.Cl
InChIInChI=1S/C13H23NO3.ClH/c1-12(2)7-10(8-13(3,4)14(12)16)17-11(15)9-5-6-9;/h9-10,16H,5-8H2,1-4H3;1H
InChIKeyBGEXDXBTNACMOP-UHFFFAOYSA-N
XLogP2.77
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.79
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Ot-551
CID 10131000
4-Acetoxy-tempo
CID 573160
1-Hydroxy-2,2,6,6-tetramethylpiperidin-4-yl acetate
CID 587880
4-Hexanoyloxy-2,2,6,6-tetramethylpiperadinyl-1-oxy
CID 171502
4-Acetyloxy-2,2,6,6-tetramethylpiperidyl acetate
CID 708860
(1-Hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl) acetate chloride
CID 139244695
CID 100998716
CID 100998716
(1-Hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 3,3,3-trifluoropropanoate
CID 91520849
(1-Hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-fluoroacetate
CID 145196217
CID 122233784
CID 122233784
CID 153419556
CID 153419556
1-Oxyl-2,2,6,6-tetramethylpiperidin-4-yl pent-4-ynoate
CID 129834564

Frequently Asked Questions

What is the IUPAC name of (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride?
The IUPAC name of (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride (CID 11482818) is (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride.
What is the SMILES notation for (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride?
The canonical SMILES for (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride is CC1(C)CC(OC(=O)C2CC2)CC(C)(C)N1O.Cl.
What is the InChIKey of (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride?
The InChIKey is BGEXDXBTNACMOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO3.ClH/c1-12(2)7-10(8-13(3,4)14(12)16)17-11(15)9-5-6-9;/h9-10,16H,5-8H2,1-4H3;1H.
What are the key properties of (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride?
(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride has a molecular weight of 277.79 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate;hydrochloride is sourced from PubChem (CID 11482818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).