2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide

C16H25N3O3 — CID 109131999

IUPAC2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide
SMILESCC(=O)N1CCN(C(=O)C2CC2C(=O)NC2CCCC2)CC1
InChIInChI=1S/C16H25N3O3/c1-11(20)18-6-8-19(9-7-18)16(22)14-10-13(14)15(21)17-12-4-2-3-5-12/h12-14H,2-10H2,1H3,(H,17,21)
InChIKeyGIZCQCVGJJBFQF-UHFFFAOYSA-N
MW307.39 g/mol
LogP0.37
Rot. Bonds3

About 2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide

2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide (PubChem CID 109131999) has the molecular formula C16H25N3O3 and a molecular weight of 307.39 g/mol. Its IUPAC name is 2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide
PubChem CID109131999
Molecular FormulaC16H25N3O3
Molecular Weight307.39 g/mol
Exact Mass307.19
IUPAC Name2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide
SMILESCC(=O)N1CCN(C(=O)C2CC2C(=O)NC2CCCC2)CC1
InChIInChI=1S/C16H25N3O3/c1-11(20)18-6-8-19(9-7-18)16(22)14-10-13(14)15(21)17-12-4-2-3-5-12/h12-14H,2-10H2,1H3,(H,17,21)
InChIKeyGIZCQCVGJJBFQF-UHFFFAOYSA-N
XLogP0.37
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-2-(morpholine-4-carbonyl)cyclopropane-1-carboxamide
CID 109131991
ethyl 4-[2-(cyclohexylcarbamoyl)cyclopropanecarbonyl]piperazine-1-carboxylate
CID 109132417
1-N,2-N-dicyclohexylcyclopropane-1,2-dicarboxamide
CID 109132364
2-N-cycloheptyl-1-N-cyclopentylcyclopropane-1,2-dicarboxamide
CID 109132055
2-(4-benzylpiperidine-1-carbonyl)-N-cycloheptylcyclopropane-1-carboxamide
CID 109139698
N-cyclopropyl-2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)cyclopropane-1-carboxamide
CID 109130885
N-cyclohexyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbonyl]cyclopropane-1-carboxamide
CID 109132423
2-(cyclooctylcarbamoyl)cyclopropane-1-carboxylic acid
CID 4638930
2-(4-acetylpiperazin-1-yl)-N-cyclododecyl-2-oxoacetamide
CID 108508318
2-(4-acetylpiperazine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 16786759
2-(4-acetylpiperazin-1-yl)-N-cyclopentylpropanamide
CID 123939055
3-(4-acetylpiperazin-1-yl)-N-cycloheptyl-3-oxopropanamide
CID 108944903

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide?
The IUPAC name of 2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide (CID 109131999) is 2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide.
What is the SMILES notation for 2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide?
The canonical SMILES for 2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide is CC(=O)N1CCN(C(=O)C2CC2C(=O)NC2CCCC2)CC1.
What is the InChIKey of 2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide?
The InChIKey is GIZCQCVGJJBFQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3/c1-11(20)18-6-8-19(9-7-18)16(22)14-10-13(14)15(21)17-12-4-2-3-5-12/h12-14H,2-10H2,1H3,(H,17,21).
What are the key properties of 2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide?
2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide has a molecular weight of 307.39 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylpiperazine-1-carbonyl)-N-cyclopentylcyclopropane-1-carboxamide is sourced from PubChem (CID 109131999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).