N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide

C14H19Cl2N3O — CID 6465282

IUPACN-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide
SMILESCCN1CCN(CC(=O)Nc2cc(Cl)ccc2Cl)CC1
InChIInChI=1S/C14H19Cl2N3O/c1-2-18-5-7-19(8-6-18)10-14(20)17-13-9-11(15)3-4-12(13)16/h3-4,9H,2,5-8,10H2,1H3,(H,17,20)
InChIKeyNZAACDRUNHMOSW-UHFFFAOYSA-N
MW316.23 g/mol
LogP2.57
Rot. Bonds4

About N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide

N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide (PubChem CID 6465282) has the molecular formula C14H19Cl2N3O and a molecular weight of 316.23 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide
PubChem CID6465282
Molecular FormulaC14H19Cl2N3O
Molecular Weight316.23 g/mol
Exact Mass315.09
IUPAC NameN-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide
SMILESCCN1CCN(CC(=O)Nc2cc(Cl)ccc2Cl)CC1
InChIInChI=1S/C14H19Cl2N3O/c1-2-18-5-7-19(8-6-18)10-14(20)17-13-9-11(15)3-4-12(13)16/h3-4,9H,2,5-8,10H2,1H3,(H,17,20)
InChIKeyNZAACDRUNHMOSW-UHFFFAOYSA-N
XLogP2.57
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.23
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[2-(2,5-dichloroanilino)-2-oxoethyl]piperazin-1-yl]-N-prop-2-enylacetamide
CID 46663083
N-(2,5-dichlorophenyl)-2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]acetamide
CID 172904520
N-(2,5-dichlorophenyl)-2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]acetamide
CID 9257466
N-(2,5-dichlorophenyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119922555
N-benzyl-2-[4-[2-(2,5-dichloroanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 29487883
N-(2,5-dichlorophenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]acetamide
CID 7949022
N-(2,5-dichlorophenyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]acetamide
CID 2655404
N-(2,5-dichlorophenyl)-4-ethyl-1,4-diazepane-1-carboxamide
CID 47090156
N-(2,5-dichlorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]acetamide
CID 2120382
2-[4-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]piperazin-1-yl]-N-(2-chlorophenyl)acetamide
CID 29162746
N-(4-bromo-2-chlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide
CID 6469594
2-(1,4-diazepan-1-yl)-N-(2,5-dichlorophenyl)acetamide;hydrochloride
CID 119906433

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide (CID 6465282) is N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide is CCN1CCN(CC(=O)Nc2cc(Cl)ccc2Cl)CC1.
What is the InChIKey of N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide?
The InChIKey is NZAACDRUNHMOSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19Cl2N3O/c1-2-18-5-7-19(8-6-18)10-14(20)17-13-9-11(15)3-4-12(13)16/h3-4,9H,2,5-8,10H2,1H3,(H,17,20).
What are the key properties of N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide?
N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide has a molecular weight of 316.23 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide is sourced from PubChem (CID 6465282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).