2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide

C9H19N3O2 — CID 142386012

IUPAC2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide
SMILESCN1CCN(CCOCC(N)=O)CC1
InChIInChI=1S/C9H19N3O2/c1-11-2-4-12(5-3-11)6-7-14-8-9(10)13/h2-8H2,1H3,(H2,10,13)
InChIKeyVIROZQYBVBFAOK-UHFFFAOYSA-N
MW201.27 g/mol
LogP-1.26
Rot. Bonds5

About 2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide

2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide (PubChem CID 142386012) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide
PubChem CID142386012
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC Name2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide
SMILESCN1CCN(CCOCC(N)=O)CC1
InChIInChI=1S/C9H19N3O2/c1-11-2-4-12(5-3-11)6-7-14-8-9(10)13/h2-8H2,1H3,(H2,10,13)
InChIKeyVIROZQYBVBFAOK-UHFFFAOYSA-N
XLogP-1.26
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-1.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[2-(4-methylpiperazin-1-yl)ethoxy]propan-2-one
CID 135174637
1-[2-(4-methylpiperazin-1-yl)ethoxy]butan-2-one
CID 156867253
2-[5-(2-piperidin-1-ylethoxy)pentoxy]acetamide
CID 142368425
3-(4-methylpiperazin-1-yl)propyl propanoate
CID 70867774
2-(4-methylpiperazin-1-yl)ethyl N-methylcarbamate
CID 174749311
ethane;O-[2-(4-methylpiperazin-1-yl)ethyl]hydroxylamine
CID 142390319
4-(4-methyl-1,4-diazepan-1-yl)butanamide
CID 175411586
N-[2-[2-[2-[2-(4-methylpiperazin-1-yl)ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 164557571
1-O-methyl 4-O-[2-(4-methylpiperazin-1-yl)ethyl] butanedioate
CID 166761469
2-[2-[3-(4-methylpiperazin-1-yl)propanoyloxy]ethoxy]ethyl 3-(4-methylpiperazin-1-yl)propanoate
CID 59193459
ethane;1-methyl-4-pentylpiperazine
CID 145099418
N-methyl-2-[4-[4-[2-[[2-[3-(4-methylpiperazin-1-yl)propoxy]acetyl]amino]ethyl]piperazin-1-yl]butoxy]acetamide
CID 134583067

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide?
The IUPAC name of 2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide (CID 142386012) is 2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide.
What is the SMILES notation for 2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide?
The canonical SMILES for 2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide is CN1CCN(CCOCC(N)=O)CC1.
What is the InChIKey of 2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide?
The InChIKey is VIROZQYBVBFAOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-11-2-4-12(5-3-11)6-7-14-8-9(10)13/h2-8H2,1H3,(H2,10,13).
What are the key properties of 2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide?
2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide has a molecular weight of 201.27 g/mol, XLogP of -1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide is sourced from PubChem (CID 142386012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).