N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide

C21H27N3O2 — CID 120753435

IUPACN-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide
SMILESCCc1cccc(NC(=O)CN2CCNCC2c2ccccc2OC)c1
InChIInChI=1S/C21H27N3O2/c1-3-16-7-6-8-17(13-16)23-21(25)15-24-12-11-22-14-19(24)18-9-4-5-10-20(18)26-2/h4-10,13,19,22H,3,11-12,14-15H2,1-2H3,(H,23,25)
InChIKeyHJRDKCNYEDARGU-UHFFFAOYSA-N
MW353.47 g/mol
LogP2.84
Rot. Bonds6

About N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide

N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide (PubChem CID 120753435) has the molecular formula C21H27N3O2 and a molecular weight of 353.47 g/mol. Its IUPAC name is N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide
PubChem CID120753435
Molecular FormulaC21H27N3O2
Molecular Weight353.47 g/mol
Exact Mass353.21
IUPAC NameN-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide
SMILESCCc1cccc(NC(=O)CN2CCNCC2c2ccccc2OC)c1
InChIInChI=1S/C21H27N3O2/c1-3-16-7-6-8-17(13-16)23-21(25)15-24-12-11-22-14-19(24)18-9-4-5-10-20(18)26-2/h4-10,13,19,22H,3,11-12,14-15H2,1-2H3,(H,23,25)
InChIKeyHJRDKCNYEDARGU-UHFFFAOYSA-N
XLogP2.84
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide;hydrochloride
CID 120753308
N-[3-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]phenyl]acetamide
CID 120754114
N-[3-[[2-(2-methoxyphenyl)piperazin-1-yl]methyl]phenyl]acetamide;hydrochloride
CID 120754113
N-(3,5-difluorophenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide;hydrochloride
CID 120753312
N-(3-ethylphenyl)-2-(2-methylpiperazin-1-yl)acetamide;hydrochloride
CID 119916597
N-(4-chlorophenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide;hydrochloride
CID 120754003
2-[2-(2-methoxyphenyl)piperazin-1-yl]-N-(4-methylsulfanylphenyl)acetamide
CID 120753860
N-(4-ethoxyphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide;hydrochloride
CID 120754009
N-benzyl-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide;hydrochloride
CID 120753744
N-(2,5-dimethoxyphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide
CID 120753359
N-(2,5-difluorophenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide
CID 120754096
N-(2-chlorophenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide
CID 120754125

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide (CID 120753435) is N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide is CCc1cccc(NC(=O)CN2CCNCC2c2ccccc2OC)c1.
What is the InChIKey of N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide?
The InChIKey is HJRDKCNYEDARGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O2/c1-3-16-7-6-8-17(13-16)23-21(25)15-24-12-11-22-14-19(24)18-9-4-5-10-20(18)26-2/h4-10,13,19,22H,3,11-12,14-15H2,1-2H3,(H,23,25).
What are the key properties of N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide?
N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide has a molecular weight of 353.47 g/mol, XLogP of 2.84, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 120753435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).