[2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone

C26H46N2O2 — CID 171722176

IUPAC[2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone
SMILESCC1(C)CCCC(C)(C)N1C(=O)C1CCCCC1C(=O)N1C(C)(C)CCCC1(C)C
InChIInChI=1S/C26H46N2O2/c1-23(2)15-11-16-24(3,4)27(23)21(29)19-13-9-10-14-20(19)22(30)28-25(5,6)17-12-18-26(28,7)8/h19-20H,9-18H2,1-8H3
InChIKeyHEJHPNUOVLFMBM-UHFFFAOYSA-N
MW418.67 g/mol
LogP5.93
Rot. Bonds2

About [2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone

[2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone (PubChem CID 171722176) has the molecular formula C26H46N2O2 and a molecular weight of 418.67 g/mol. Its IUPAC name is [2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone
PubChem CID171722176
Molecular FormulaC26H46N2O2
Molecular Weight418.67 g/mol
Exact Mass418.36
IUPAC Name[2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone
SMILESCC1(C)CCCC(C)(C)N1C(=O)C1CCCCC1C(=O)N1C(C)(C)CCCC1(C)C
InChIInChI=1S/C26H46N2O2/c1-23(2)15-11-16-24(3,4)27(23)21(29)19-13-9-10-14-20(19)22(30)28-25(5,6)17-12-18-26(28,7)8/h19-20H,9-18H2,1-8H3
InChIKeyHEJHPNUOVLFMBM-UHFFFAOYSA-N
XLogP5.93
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.67
LogP ≤ 55.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone?
The IUPAC name of [2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone (CID 171722176) is [2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone.
What is the SMILES notation for [2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone?
The canonical SMILES for [2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone is CC1(C)CCCC(C)(C)N1C(=O)C1CCCCC1C(=O)N1C(C)(C)CCCC1(C)C.
What is the InChIKey of [2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone?
The InChIKey is HEJHPNUOVLFMBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H46N2O2/c1-23(2)15-11-16-24(3,4)27(23)21(29)19-13-9-10-14-20(19)22(30)28-25(5,6)17-12-18-26(28,7)8/h19-20H,9-18H2,1-8H3.
What are the key properties of [2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone?
[2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone has a molecular weight of 418.67 g/mol, XLogP of 5.93, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,2,6,6-tetramethylpiperidine-1-carbonyl)cyclohexyl]-(2,2,6,6-tetramethylpiperidin-1-yl)methanone is sourced from PubChem (CID 171722176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).