N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide

C15H28N4O2 — CID 63872768

IUPACN-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide
SMILESCC1CN(CC(=O)NC(=O)NC2CCCCC2)CC(C)N1
InChIInChI=1S/C15H28N4O2/c1-11-8-19(9-12(2)16-11)10-14(20)18-15(21)17-13-6-4-3-5-7-13/h11-13,16H,3-10H2,1-2H3,(H2,17,18,20,21)
InChIKeyHEPPPCCMUSXYKF-UHFFFAOYSA-N
MW296.41 g/mol
LogP0.83
Rot. Bonds3

About N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide

N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide (PubChem CID 63872768) has the molecular formula C15H28N4O2 and a molecular weight of 296.41 g/mol. Its IUPAC name is N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide
PubChem CID63872768
Molecular FormulaC15H28N4O2
Molecular Weight296.41 g/mol
Exact Mass296.22
IUPAC NameN-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide
SMILESCC1CN(CC(=O)NC(=O)NC2CCCCC2)CC(C)N1
InChIInChI=1S/C15H28N4O2/c1-11-8-19(9-12(2)16-11)10-14(20)18-15(21)17-13-6-4-3-5-7-13/h11-13,16H,3-10H2,1-2H3,(H2,17,18,20,21)
InChIKeyHEPPPCCMUSXYKF-UHFFFAOYSA-N
XLogP0.83
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 50.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopentylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide
CID 63873098
N-cycloheptyl-2-(3,5-dimethylpiperazin-1-yl)acetamide;hydrochloride
CID 119924112
N-(cyclohexylcarbamoyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 2655086
2-(azepan-1-yl)-N-(cyclopentylcarbamoyl)acetamide
CID 8895713
N-(cyclohexylcarbamoyl)-2-[3-(methylamino)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119905800
N-(cyclopropylcarbamoyl)-2-(2,6-dimethylmorpholin-4-yl)acetamide
CID 17421099
2-(4-aminopiperidin-1-yl)-N-(cyclohexylcarbamoyl)acetamide
CID 43556566
N-(cyclopentylcarbamoyl)-2-(1,4-diazepan-1-yl)acetamide
CID 43162551
N-[1-[2-(cyclohexylcarbamoylamino)-2-oxoethyl]piperidin-4-yl]cyclohexanecarboxamide
CID 86860953
2-[(3R)-3-aminopiperidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide
CID 102977459
2-[3-(1-aminoethyl)piperidin-1-yl]-N-(cyclohexylcarbamoyl)acetamide;hydrochloride
CID 119925750
2-(3,5-dimethylpiperazin-1-yl)-N-methylacetamide
CID 63872002

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide?
The IUPAC name of N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide (CID 63872768) is N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide?
The canonical SMILES for N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide is CC1CN(CC(=O)NC(=O)NC2CCCCC2)CC(C)N1.
What is the InChIKey of N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide?
The InChIKey is HEPPPCCMUSXYKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-11-8-19(9-12(2)16-11)10-14(20)18-15(21)17-13-6-4-3-5-7-13/h11-13,16H,3-10H2,1-2H3,(H2,17,18,20,21).
What are the key properties of N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide?
N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide has a molecular weight of 296.41 g/mol, XLogP of 0.83, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylcarbamoyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide is sourced from PubChem (CID 63872768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).