2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide

C22H40N2O2 — CID 170668408

IUPAC2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide
SMILESCC(C)(C)C(=O)C1CCCC(NC(=O)CC2CCN(C(C)(C)C)CC2)C1
InChIInChI=1S/C22H40N2O2/c1-21(2,3)20(26)17-8-7-9-18(15-17)23-19(25)14-16-10-12-24(13-11-16)22(4,5)6/h16-18H,7-15H2,1-6H3,(H,23,25)
InChIKeyOYSDRBGABZIYOD-UHFFFAOYSA-N
MW364.57 g/mol
LogP4.18
Rot. Bonds4

About 2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide

2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide (PubChem CID 170668408) has the molecular formula C22H40N2O2 and a molecular weight of 364.57 g/mol. Its IUPAC name is 2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide.

Molecular Properties

Compound Name2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide
PubChem CID170668408
Molecular FormulaC22H40N2O2
Molecular Weight364.57 g/mol
Exact Mass364.31
IUPAC Name2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide
SMILESCC(C)(C)C(=O)C1CCCC(NC(=O)CC2CCN(C(C)(C)C)CC2)C1
InChIInChI=1S/C22H40N2O2/c1-21(2,3)20(26)17-8-7-9-18(15-17)23-19(25)14-16-10-12-24(13-11-16)22(4,5)6/h16-18H,7-15H2,1-6H3,(H,23,25)
InChIKeyOYSDRBGABZIYOD-UHFFFAOYSA-N
XLogP4.18
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.57
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide?
The IUPAC name of 2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide (CID 170668408) is 2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide.
What is the SMILES notation for 2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide?
The canonical SMILES for 2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide is CC(C)(C)C(=O)C1CCCC(NC(=O)CC2CCN(C(C)(C)C)CC2)C1.
What is the InChIKey of 2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide?
The InChIKey is OYSDRBGABZIYOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H40N2O2/c1-21(2,3)20(26)17-8-7-9-18(15-17)23-19(25)14-16-10-12-24(13-11-16)22(4,5)6/h16-18H,7-15H2,1-6H3,(H,23,25).
What are the key properties of 2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide?
2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide has a molecular weight of 364.57 g/mol, XLogP of 4.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-tert-butylpiperidin-4-yl)-N-[3-(2,2-dimethylpropanoyl)cyclohexyl]acetamide is sourced from PubChem (CID 170668408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).