N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide

C19H30N4O2S — CID 47073373

IUPACN-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(CCc2cccs2)CC1)NC(=O)NC1CCCCC1
InChIInChI=1S/C19H30N4O2S/c24-18(21-19(25)20-16-5-2-1-3-6-16)15-23-12-10-22(11-13-23)9-8-17-7-4-14-26-17/h4,7,14,16H,1-3,5-6,8-13,15H2,(H2,20,21,24,25)
InChIKeyYQNHQLAUPFPWMZ-UHFFFAOYSA-N
MW378.54 g/mol
LogP2.07
Rot. Bonds6

About N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide

N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide (PubChem CID 47073373) has the molecular formula C19H30N4O2S and a molecular weight of 378.54 g/mol. Its IUPAC name is N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide
PubChem CID47073373
Molecular FormulaC19H30N4O2S
Molecular Weight378.54 g/mol
Exact Mass378.21
IUPAC NameN-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(CCc2cccs2)CC1)NC(=O)NC1CCCCC1
InChIInChI=1S/C19H30N4O2S/c24-18(21-19(25)20-16-5-2-1-3-6-16)15-23-12-10-22(11-13-23)9-8-17-7-4-14-26-17/h4,7,14,16H,1-3,5-6,8-13,15H2,(H2,20,21,24,25)
InChIKeyYQNHQLAUPFPWMZ-UHFFFAOYSA-N
XLogP2.07
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.54
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]propanamide
CID 118877843
2-(azepan-1-yl)-N-(cyclopentylcarbamoyl)acetamide
CID 8895713
1-cyclopentyl-3-[1-(3-thiophen-2-ylpropanoyl)piperidin-4-yl]urea
CID 110822094
N-(cyclohexylcarbamoyl)-2-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]acetamide
CID 9208528
1-cyclohexyl-3-[1-(2-thiophen-2-ylacetyl)piperidin-4-yl]urea
CID 110820715
N-cyclooctyl-2-thiophen-2-ylacetamide
CID 17256729
N-(cyclohexylcarbamoyl)-2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]acetamide
CID 30649050
2-(4-acetyl-1,4-diazepan-1-yl)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
CID 27133290
2-methyl-N-[1-[2-oxo-2-(thiophen-2-ylmethylcarbamoylamino)ethyl]piperidin-4-yl]propanamide
CID 55739363
2-(4-aminopiperidin-1-yl)-N-(cyclohexylcarbamoyl)acetamide
CID 43556566
N-(cyclohexylcarbamoyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 2655086
1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]ethanone
CID 95761889

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide (CID 47073373) is N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide is O=C(CN1CCN(CCc2cccs2)CC1)NC(=O)NC1CCCCC1.
What is the InChIKey of N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide?
The InChIKey is YQNHQLAUPFPWMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O2S/c24-18(21-19(25)20-16-5-2-1-3-6-16)15-23-12-10-22(11-13-23)9-8-17-7-4-14-26-17/h4,7,14,16H,1-3,5-6,8-13,15H2,(H2,20,21,24,25).
What are the key properties of N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide?
N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide has a molecular weight of 378.54 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 47073373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).