2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide

C16H20ClN3O2 — CID 35372589

IUPAC2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide
SMILESO=C(CN1CCN(C(=O)c2ccccc2Cl)CC1)NC1CC1
InChIInChI=1S/C16H20ClN3O2/c17-14-4-2-1-3-13(14)16(22)20-9-7-19(8-10-20)11-15(21)18-12-5-6-12/h1-4,12H,5-11H2,(H,18,21)
InChIKeyYCFUDGBSOQQDAJ-UHFFFAOYSA-N
MW321.81 g/mol
LogP1.38
Rot. Bonds4

About 2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide

2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide (PubChem CID 35372589) has the molecular formula C16H20ClN3O2 and a molecular weight of 321.81 g/mol. Its IUPAC name is 2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide
PubChem CID35372589
Molecular FormulaC16H20ClN3O2
Molecular Weight321.81 g/mol
Exact Mass321.12
IUPAC Name2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide
SMILESO=C(CN1CCN(C(=O)c2ccccc2Cl)CC1)NC1CC1
InChIInChI=1S/C16H20ClN3O2/c17-14-4-2-1-3-13(14)16(22)20-9-7-19(8-10-20)11-15(21)18-12-5-6-12/h1-4,12H,5-11H2,(H,18,21)
InChIKeyYCFUDGBSOQQDAJ-UHFFFAOYSA-N
XLogP1.38
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.81
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-[4-(2-fluorobenzoyl)piperazin-1-yl]acetamide
CID 51221138
2-[4-[2-[2-(2-chlorobenzoyl)hydrazinyl]-2-oxoethyl]piperazin-1-yl]-N-cyclopropylacetamide
CID 55411004
N-cyclopropyl-2-[4-(3-hydroxynaphthalene-2-carbonyl)piperazin-1-yl]acetamide
CID 51206869
N-cyclopropyl-2-[4-[2-(difluoromethoxy)benzoyl]piperazin-1-yl]acetamide
CID 35373996
N-cyclopropyl-2-[4-[2-(trifluoromethylsulfanyl)benzoyl]piperazin-1-yl]acetamide
CID 39465986
N-cyclopropyl-2-[4-[2-(thiophene-2-carbonyl)benzoyl]piperazin-1-yl]acetamide
CID 51206929
2-[4-(2-chloro-5-nitrobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide
CID 78810203
N-cyclopropyl-2-[4-[2-(3,4-dimethylbenzoyl)benzoyl]piperazin-1-yl]acetamide
CID 36936549
N-cyclopropyl-2-[4-[2-(2,6-dichloroanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 30740870
2-[4-[2-(2-chlorophenyl)cyclopropanecarbonyl]piperazin-1-yl]-N-cyclopropylacetamide
CID 51295287
2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-N-cyclopropylacetamide
CID 32717261
N-[1-(2-chlorobenzoyl)piperidin-4-yl]-2-(4-fluorophenyl)acetamide
CID 108549660

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide?
The IUPAC name of 2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide (CID 35372589) is 2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide?
The canonical SMILES for 2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide is O=C(CN1CCN(C(=O)c2ccccc2Cl)CC1)NC1CC1.
What is the InChIKey of 2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide?
The InChIKey is YCFUDGBSOQQDAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20ClN3O2/c17-14-4-2-1-3-13(14)16(22)20-9-7-19(8-10-20)11-15(21)18-12-5-6-12/h1-4,12H,5-11H2,(H,18,21).
What are the key properties of 2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide?
2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide has a molecular weight of 321.81 g/mol, XLogP of 1.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-chlorobenzoyl)piperazin-1-yl]-N-cyclopropylacetamide is sourced from PubChem (CID 35372589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).