ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane

C13H28N2O2 — CID 153352892

IUPACethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane
SMILESCC.CC1CCN(CC(N)=O)C(=O)C1.CCC
InChIInChI=1S/C8H14N2O2.C3H8.C2H6/c1-6-2-3-10(5-7(9)11)8(12)4-6;1-3-2;1-2/h6H,2-5H2,1H3,(H2,9,11);3H2,1-2H3;1-2H3
InChIKeyVFMVIERKKQNFMA-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.17
Rot. Bonds2

About ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane

ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane (PubChem CID 153352892) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane.

Molecular Properties

Compound Nameethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane
PubChem CID153352892
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Nameethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane
SMILESCC.CC1CCN(CC(N)=O)C(=O)C1.CCC
InChIInChI=1S/C8H14N2O2.C3H8.C2H6/c1-6-2-3-10(5-7(9)11)8(12)4-6;1-3-2;1-2/h6H,2-5H2,1H3,(H2,9,11);3H2,1-2H3;1-2H3
InChIKeyVFMVIERKKQNFMA-UHFFFAOYSA-N
XLogP2.17
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane?
The IUPAC name of ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane (CID 153352892) is ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane.
What is the SMILES notation for ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane?
The canonical SMILES for ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane is CC.CC1CCN(CC(N)=O)C(=O)C1.CCC.
What is the InChIKey of ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane?
The InChIKey is VFMVIERKKQNFMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2.C3H8.C2H6/c1-6-2-3-10(5-7(9)11)8(12)4-6;1-3-2;1-2/h6H,2-5H2,1H3,(H2,9,11);3H2,1-2H3;1-2H3.
What are the key properties of ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane?
ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane has a molecular weight of 244.38 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(4-methyl-2-oxopiperidin-1-yl)acetamide;propane is sourced from PubChem (CID 153352892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).