2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide

C18H22N4O3S — CID 72844240

IUPAC2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide
SMILESCC(=O)c1cc(CC(=O)N2CCCC(c3nccn3CC(N)=O)C2)cs1
InChIInChI=1S/C18H22N4O3S/c1-12(23)15-7-13(11-26-15)8-17(25)21-5-2-3-14(9-21)18-20-4-6-22(18)10-16(19)24/h4,6-7,11,14H,2-3,5,8-10H2,1H3,(H2,19,24)
InChIKeyMUTTXVZAWLLOOO-UHFFFAOYSA-N
MW374.47 g/mol
LogP1.58
Rot. Bonds6

About 2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide

2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide (PubChem CID 72844240) has the molecular formula C18H22N4O3S and a molecular weight of 374.47 g/mol. Its IUPAC name is 2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide.

Molecular Properties

Compound Name2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide
PubChem CID72844240
Molecular FormulaC18H22N4O3S
Molecular Weight374.47 g/mol
Exact Mass374.14
IUPAC Name2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide
SMILESCC(=O)c1cc(CC(=O)N2CCCC(c3nccn3CC(N)=O)C2)cs1
InChIInChI=1S/C18H22N4O3S/c1-12(23)15-7-13(11-26-15)8-17(25)21-5-2-3-14(9-21)18-20-4-6-22(18)10-16(19)24/h4,6-7,11,14H,2-3,5,8-10H2,1H3,(H2,19,24)
InChIKeyMUTTXVZAWLLOOO-UHFFFAOYSA-N
XLogP1.58
TPSA98.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.47
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[2-[(3S)-1-[2-(3-fluoro-4-hydroxyphenyl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide
CID 97278954
2-(5-acetylthiophen-3-yl)-1-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethanone
CID 118789182
2-[2-[(3S)-1-(2-methylpropanoyl)piperidin-3-yl]imidazol-1-yl]acetamide
CID 97269942
2-[2-[(3R)-1-[3-(4-methyl-1,3-thiazol-5-yl)propanoyl]piperidin-3-yl]imidazol-1-yl]acetamide
CID 97277457
2-[2-[(3R)-1-(2-cyclopentylacetyl)piperidin-3-yl]imidazol-1-yl]acetamide
CID 97283989
2-[2-[(3S)-1-[3-(4-methylphenyl)propanoyl]piperidin-3-yl]imidazol-1-yl]acetamide
CID 97282540
2-[2-[(3S)-1-[2-(2-methoxyphenyl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide
CID 97282167
2-[2-[(3R)-1-[2-(2-methoxyphenyl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide
CID 97282168
2-[2-[1-[2-(4-acetylphenoxy)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide
CID 72939253
2-[2-[1-[3-(2-ethylimidazol-1-yl)propanoyl]piperidin-3-yl]imidazol-1-yl]acetamide
CID 72867056
2-[2-[(3S)-1-[3-[4-(dimethylamino)phenyl]propanoyl]piperidin-3-yl]imidazol-1-yl]acetamide
CID 97276868
2-[2-[(3R)-1-[4-(4-chlorophenyl)butanoyl]piperidin-3-yl]imidazol-1-yl]acetamide
CID 97276039

Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide?
The IUPAC name of 2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide (CID 72844240) is 2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide.
What is the SMILES notation for 2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide?
The canonical SMILES for 2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide is CC(=O)c1cc(CC(=O)N2CCCC(c3nccn3CC(N)=O)C2)cs1.
What is the InChIKey of 2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide?
The InChIKey is MUTTXVZAWLLOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O3S/c1-12(23)15-7-13(11-26-15)8-17(25)21-5-2-3-14(9-21)18-20-4-6-22(18)10-16(19)24/h4,6-7,11,14H,2-3,5,8-10H2,1H3,(H2,19,24).
What are the key properties of 2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide?
2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide has a molecular weight of 374.47 g/mol, XLogP of 1.58, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-[2-(5-acetylthiophen-3-yl)acetyl]piperidin-3-yl]imidazol-1-yl]acetamide is sourced from PubChem (CID 72844240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).