2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine

C19H36N2O2-2 — CID 20749510

IUPAC2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine
SMILESCC1(C)CC(CC2CC(C)(C)N([O-])C(C)(C)C2)CC(C)(C)N1[O-]
InChIInChI=1S/C19H36N2O2/c1-16(2)10-14(11-17(3,4)20(16)22)9-15-12-18(5,6)21(23)19(7,8)13-15/h14-15H,9-13H2,1-8H3/q-2
InChIKeyGZLSRSBNUOHAQC-UHFFFAOYSA-N
MW324.51 g/mol
LogP4.91
Rot. Bonds2

About 2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine

2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine (PubChem CID 20749510) has the molecular formula C19H36N2O2-2 and a molecular weight of 324.51 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine
PubChem CID20749510
Molecular FormulaC19H36N2O2-2
Molecular Weight324.51 g/mol
Exact Mass324.28
IUPAC Name2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine
SMILESCC1(C)CC(CC2CC(C)(C)N([O-])C(C)(C)C2)CC(C)(C)N1[O-]
InChIInChI=1S/C19H36N2O2/c1-16(2)10-14(11-17(3,4)20(16)22)9-15-12-18(5,6)21(23)19(7,8)13-15/h14-15H,9-13H2,1-8H3/q-2
InChIKeyGZLSRSBNUOHAQC-UHFFFAOYSA-N
XLogP4.91
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.51
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine?
The IUPAC name of 2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine (CID 20749510) is 2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine.
What is the SMILES notation for 2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine?
The canonical SMILES for 2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine is CC1(C)CC(CC2CC(C)(C)N([O-])C(C)(C)C2)CC(C)(C)N1[O-].
What is the InChIKey of 2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine?
The InChIKey is GZLSRSBNUOHAQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36N2O2/c1-16(2)10-14(11-17(3,4)20(16)22)9-15-12-18(5,6)21(23)19(7,8)13-15/h14-15H,9-13H2,1-8H3/q-2.
What are the key properties of 2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine?
2,2,6,6-tetramethyl-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine has a molecular weight of 324.51 g/mol, XLogP of 4.91, 2 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-1-oxido-4-[(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl)methyl]piperidine is sourced from PubChem (CID 20749510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).