2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide

C22H44N2O — CID 135191358

IUPAC2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide
SMILESCN1C(C)(C)CC(NC(=O)C(C)(CC(C)(C)C)C(C)(C)C)CC1(C)C
InChIInChI=1S/C22H44N2O/c1-18(2,3)15-22(11,19(4,5)6)17(25)23-16-13-20(7,8)24(12)21(9,10)14-16/h16H,13-15H2,1-12H3,(H,23,25)
InChIKeyJSGXBUBJZNOINO-UHFFFAOYSA-N
MW352.61 g/mol
LogP5.24
Rot. Bonds3

About 2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide

2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide (PubChem CID 135191358) has the molecular formula C22H44N2O and a molecular weight of 352.61 g/mol. Its IUPAC name is 2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide.

Molecular Properties

Compound Name2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide
PubChem CID135191358
Molecular FormulaC22H44N2O
Molecular Weight352.61 g/mol
Exact Mass352.35
IUPAC Name2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide
SMILESCN1C(C)(C)CC(NC(=O)C(C)(CC(C)(C)C)C(C)(C)C)CC1(C)C
InChIInChI=1S/C22H44N2O/c1-18(2,3)15-22(11,19(4,5)6)17(25)23-16-13-20(7,8)24(12)21(9,10)14-16/h16H,13-15H2,1-12H3,(H,23,25)
InChIKeyJSGXBUBJZNOINO-UHFFFAOYSA-N
XLogP5.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.61
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide?
The IUPAC name of 2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide (CID 135191358) is 2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide.
What is the SMILES notation for 2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide?
The canonical SMILES for 2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide is CN1C(C)(C)CC(NC(=O)C(C)(CC(C)(C)C)C(C)(C)C)CC1(C)C.
What is the InChIKey of 2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide?
The InChIKey is JSGXBUBJZNOINO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H44N2O/c1-18(2,3)15-22(11,19(4,5)6)17(25)23-16-13-20(7,8)24(12)21(9,10)14-16/h16H,13-15H2,1-12H3,(H,23,25).
What are the key properties of 2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide?
2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide has a molecular weight of 352.61 g/mol, XLogP of 5.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-2,4,4-trimethyl-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)pentanamide is sourced from PubChem (CID 135191358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).