N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide

C18H32N4O — CID 91839266

IUPACN-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
SMILESCc1ncn(CCNC(=O)CC2CC(C)(C)NC(C)(C)C2)c1C
InChIInChI=1S/C18H32N4O/c1-13-14(2)22(12-20-13)8-7-19-16(23)9-15-10-17(3,4)21-18(5,6)11-15/h12,15,21H,7-11H2,1-6H3,(H,19,23)
InChIKeyKYFLDBPZILFIDY-UHFFFAOYSA-N
MW320.48 g/mol
LogP2.56
Rot. Bonds5

About N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide

N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide (PubChem CID 91839266) has the molecular formula C18H32N4O and a molecular weight of 320.48 g/mol. Its IUPAC name is N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
PubChem CID91839266
Molecular FormulaC18H32N4O
Molecular Weight320.48 g/mol
Exact Mass320.26
IUPAC NameN-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
SMILESCc1ncn(CCNC(=O)CC2CC(C)(C)NC(C)(C)C2)c1C
InChIInChI=1S/C18H32N4O/c1-13-14(2)22(12-20-13)8-7-19-16(23)9-15-10-17(3,4)21-18(5,6)11-15/h12,15,21H,7-11H2,1-6H3,(H,19,23)
InChIKeyKYFLDBPZILFIDY-UHFFFAOYSA-N
XLogP2.56
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.48
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The IUPAC name of N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide (CID 91839266) is N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The canonical SMILES for N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide is Cc1ncn(CCNC(=O)CC2CC(C)(C)NC(C)(C)C2)c1C.
What is the InChIKey of N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The InChIKey is KYFLDBPZILFIDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N4O/c1-13-14(2)22(12-20-13)8-7-19-16(23)9-15-10-17(3,4)21-18(5,6)11-15/h12,15,21H,7-11H2,1-6H3,(H,19,23).
What are the key properties of N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide has a molecular weight of 320.48 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide is sourced from PubChem (CID 91839266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).