2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide

C20H37N3O2 — CID 46295194

IUPAC2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide
SMILESCCN(CC)CCNC(=O)CC1CCN(C(=O)C2CCCCC2)CC1
InChIInChI=1S/C20H37N3O2/c1-3-22(4-2)15-12-21-19(24)16-17-10-13-23(14-11-17)20(25)18-8-6-5-7-9-18/h17-18H,3-16H2,1-2H3,(H,21,24)
InChIKeyHYQIZMNDDBJJEW-UHFFFAOYSA-N
MW351.54 g/mol
LogP2.65
Rot. Bonds8

About 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide

2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide (PubChem CID 46295194) has the molecular formula C20H37N3O2 and a molecular weight of 351.54 g/mol. Its IUPAC name is 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide
PubChem CID46295194
Molecular FormulaC20H37N3O2
Molecular Weight351.54 g/mol
Exact Mass351.29
IUPAC Name2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide
SMILESCCN(CC)CCNC(=O)CC1CCN(C(=O)C2CCCCC2)CC1
InChIInChI=1S/C20H37N3O2/c1-3-22(4-2)15-12-21-19(24)16-17-10-13-23(14-11-17)20(25)18-8-6-5-7-9-18/h17-18H,3-16H2,1-2H3,(H,21,24)
InChIKeyHYQIZMNDDBJJEW-UHFFFAOYSA-N
XLogP2.65
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.54
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide?
The IUPAC name of 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide (CID 46295194) is 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide.
What is the SMILES notation for 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide?
The canonical SMILES for 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide is CCN(CC)CCNC(=O)CC1CCN(C(=O)C2CCCCC2)CC1.
What is the InChIKey of 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide?
The InChIKey is HYQIZMNDDBJJEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H37N3O2/c1-3-22(4-2)15-12-21-19(24)16-17-10-13-23(14-11-17)20(25)18-8-6-5-7-9-18/h17-18H,3-16H2,1-2H3,(H,21,24).
What are the key properties of 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide?
2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide has a molecular weight of 351.54 g/mol, XLogP of 2.65, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-[2-(diethylamino)ethyl]acetamide is sourced from PubChem (CID 46295194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).