N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide

C15H23N3O2 — CID 78787987

IUPACN-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
SMILESCCNC(=O)CN1CCN(c2cccc(OC)c2)CC1
InChIInChI=1S/C15H23N3O2/c1-3-16-15(19)12-17-7-9-18(10-8-17)13-5-4-6-14(11-13)20-2/h4-6,11H,3,7-10,12H2,1-2H3,(H,16,19)
InChIKeyTUZAOTUYZOZOTB-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.95
Rot. Bonds5

About N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide

N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide (PubChem CID 78787987) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
PubChem CID78787987
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
SMILESCCNC(=O)CN1CCN(c2cccc(OC)c2)CC1
InChIInChI=1S/C15H23N3O2/c1-3-16-15(19)12-17-7-9-18(10-8-17)13-5-4-6-14(11-13)20-2/h4-6,11H,3,7-10,12H2,1-2H3,(H,16,19)
InChIKeyTUZAOTUYZOZOTB-UHFFFAOYSA-N
XLogP0.95
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-butan-2-yl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 17401834
2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(2-phenoxyethyl)acetamide
CID 38125172
N-[(2-methoxyphenyl)methyl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 8592411
N-(4-acetamidophenyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 41312804
2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(2-phenylsulfanylethyl)acetamide
CID 9029313
N-cyclopentyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 6467557
N-(3-ethylphenyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 8592549
N-cyclohexyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 6468252
N-(2,4-dimethoxyphenyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 6466970
N-(3-bromophenyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 2698418
2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 40696474
N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 8592483

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide?
The IUPAC name of N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide (CID 78787987) is N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide is CCNC(=O)CN1CCN(c2cccc(OC)c2)CC1.
What is the InChIKey of N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide?
The InChIKey is TUZAOTUYZOZOTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-16-15(19)12-17-7-9-18(10-8-17)13-5-4-6-14(11-13)20-2/h4-6,11H,3,7-10,12H2,1-2H3,(H,16,19).
What are the key properties of N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide?
N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide has a molecular weight of 277.37 g/mol, XLogP of 0.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 78787987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).