5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid

C14H23NO4 — CID 56693735

IUPAC5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid
SMILESCC1(C)CC(=O)CC(C)(C)N1C(=O)CCCC(=O)O
InChIInChI=1S/C14H23NO4/c1-13(2)8-10(16)9-14(3,4)15(13)11(17)6-5-7-12(18)19/h5-9H2,1-4H3,(H,18,19)
InChIKeyXQDNNTDXKOBQES-UHFFFAOYSA-N
MW269.34 g/mol
LogP1.99
Rot. Bonds4

About 5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid

5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid (PubChem CID 56693735) has the molecular formula C14H23NO4 and a molecular weight of 269.34 g/mol. Its IUPAC name is 5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid.

Molecular Properties

Compound Name5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid
PubChem CID56693735
Molecular FormulaC14H23NO4
Molecular Weight269.34 g/mol
Exact Mass269.16
IUPAC Name5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid
SMILESCC1(C)CC(=O)CC(C)(C)N1C(=O)CCCC(=O)O
InChIInChI=1S/C14H23NO4/c1-13(2)8-10(16)9-14(3,4)15(13)11(17)6-5-7-12(18)19/h5-9H2,1-4H3,(H,18,19)
InChIKeyXQDNNTDXKOBQES-UHFFFAOYSA-N
XLogP1.99
TPSA74.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2,2-dimethyl-4-oxopyrrolidin-1-yl)pentanoic acid
CID 163404270
5-oxo-5-(4-oxopiperidin-1-yl)pentanoic acid
CID 2760467
1,4-bis(2,2,6,6-tetramethylpiperidin-1-yl)butane-1,4-dione
CID 90092167
2-[bis[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid;pentakis(1,2,2,6,6-pentamethylpiperidin-4-one)
CID 173026071
12-(3,3-dimethyl-5-methylidene-2,6-dioxopiperidin-1-yl)dodecanoic acid
CID 169291208
chloromethane;pentanedioic acid
CID 159659659
erbium;pentanedioic acid
CID 87931794
azane;bis(pentanedioic acid)
CID 138524332
CID 87067075
CID 87067075
pentanedioic acid;stibane
CID 173344083
5-(3-hydroxy-3-propan-2-ylazetidin-1-yl)-5-oxopentanoic acid
CID 107214631
Tempone
CID 520789

Frequently Asked Questions

What is the IUPAC name of 5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid?
The IUPAC name of 5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid (CID 56693735) is 5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid.
What is the SMILES notation for 5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid?
The canonical SMILES for 5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid is CC1(C)CC(=O)CC(C)(C)N1C(=O)CCCC(=O)O.
What is the InChIKey of 5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid?
The InChIKey is XQDNNTDXKOBQES-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO4/c1-13(2)8-10(16)9-14(3,4)15(13)11(17)6-5-7-12(18)19/h5-9H2,1-4H3,(H,18,19).
What are the key properties of 5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid?
5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid has a molecular weight of 269.34 g/mol, XLogP of 1.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-5-(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)pentanoic acid is sourced from PubChem (CID 56693735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).