N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide

C16H25N3O2 — CID 78792872

IUPACN,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide
SMILESCN(C)C(=O)CN1CCN(CCOc2ccccc2)CC1
InChIInChI=1S/C16H25N3O2/c1-17(2)16(20)14-19-10-8-18(9-11-19)12-13-21-15-6-4-3-5-7-15/h3-7H,8-14H2,1-2H3
InChIKeyMEFFHOHMOQGXMD-UHFFFAOYSA-N
MW291.39 g/mol
LogP0.77
Rot. Bonds6

About N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide

N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide (PubChem CID 78792872) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide
PubChem CID78792872
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC NameN,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide
SMILESCN(C)C(=O)CN1CCN(CCOc2ccccc2)CC1
InChIInChI=1S/C16H25N3O2/c1-17(2)16(20)14-19-10-8-18(9-11-19)12-13-21-15-6-4-3-5-7-15/h3-7H,8-14H2,1-2H3
InChIKeyMEFFHOHMOQGXMD-UHFFFAOYSA-N
XLogP0.77
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-2-ylmethyl)-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide
CID 78792851
N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]-N-(thiophen-2-ylmethyl)acetamide
CID 55362422
phenyl 2-[4-(2-phenoxyethyl)piperazin-1-yl]acetate
CID 59382148
ethane;N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide
CID 142596800
2-[4-[5-(4-formylphenoxy)pentyl]piperazin-1-yl]-N,N-dimethylacetamide
CID 87732200
N-(2-cyanoethyl)-2-[4-(2-phenoxyethyl)piperazin-1-yl]-N-phenylacetamide
CID 78792864
N-[(2R)-3-methylbutan-2-yl]-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide
CID 30986083
4-[4-(2-phenoxyethyl)piperazin-1-yl]butanoic acid
CID 119134542
1,4-bis(2-phenoxyethyl)-1,4-diazepane
CID 58861609
N,N-dimethyl-2-[[[4-(2-phenoxyethyl)piperazin-1-yl]-(propylamino)methylidene]amino]acetamide
CID 110038095
2-[4-[5-[4-(4-chlorobenzoyl)phenoxy]pentyl]piperazin-1-yl]-N,N-dimethylacetamide
CID 24995255
N-methyl-N-(2-phenoxyethyl)-2-piperazin-1-ylacetamide
CID 60937635

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide?
The IUPAC name of N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide (CID 78792872) is N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide is CN(C)C(=O)CN1CCN(CCOc2ccccc2)CC1.
What is the InChIKey of N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide?
The InChIKey is MEFFHOHMOQGXMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-17(2)16(20)14-19-10-8-18(9-11-19)12-13-21-15-6-4-3-5-7-15/h3-7H,8-14H2,1-2H3.
What are the key properties of N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide?
N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide has a molecular weight of 291.39 g/mol, XLogP of 0.77, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 78792872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).