N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide

C14H24N4O — CID 91840394

IUPACN-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide
SMILESCCc1nccn1CCN1CCCC(NC(C)=O)C1
InChIInChI=1S/C14H24N4O/c1-3-14-15-6-8-18(14)10-9-17-7-4-5-13(11-17)16-12(2)19/h6,8,13H,3-5,7,9-11H2,1-2H3,(H,16,19)
InChIKeyJPVMULNGNBTVJK-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.05
Rot. Bonds5

About N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide

N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide (PubChem CID 91840394) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide
PubChem CID91840394
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide
SMILESCCc1nccn1CCN1CCCC(NC(C)=O)C1
InChIInChI=1S/C14H24N4O/c1-3-14-15-6-8-18(14)10-9-17-7-4-5-13(11-17)16-12(2)19/h6,8,13H,3-5,7,9-11H2,1-2H3,(H,16,19)
InChIKeyJPVMULNGNBTVJK-UHFFFAOYSA-N
XLogP1.05
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide?
The IUPAC name of N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide (CID 91840394) is N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide.
What is the SMILES notation for N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide?
The canonical SMILES for N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide is CCc1nccn1CCN1CCCC(NC(C)=O)C1.
What is the InChIKey of N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide?
The InChIKey is JPVMULNGNBTVJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-14-15-6-8-18(14)10-9-17-7-4-5-13(11-17)16-12(2)19/h6,8,13H,3-5,7,9-11H2,1-2H3,(H,16,19).
What are the key properties of N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide?
N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(2-ethylimidazol-1-yl)ethyl]piperidin-3-yl]acetamide is sourced from PubChem (CID 91840394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).