N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide

C13H27N3O2 — CID 54944353

IUPACN-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide
SMILESCOCCN(CC(C)C)C(=O)CN1CCNCC1
InChIInChI=1S/C13H27N3O2/c1-12(2)10-16(8-9-18-3)13(17)11-15-6-4-14-5-7-15/h12,14H,4-11H2,1-3H3
InChIKeyKTKVIOJGPBXXAU-UHFFFAOYSA-N
MW257.38 g/mol
LogP0.02
Rot. Bonds7

About N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide

N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide (PubChem CID 54944353) has the molecular formula C13H27N3O2 and a molecular weight of 257.38 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide
PubChem CID54944353
Molecular FormulaC13H27N3O2
Molecular Weight257.38 g/mol
Exact Mass257.21
IUPAC NameN-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide
SMILESCOCCN(CC(C)C)C(=O)CN1CCNCC1
InChIInChI=1S/C13H27N3O2/c1-12(2)10-16(8-9-18-3)13(17)11-15-6-4-14-5-7-15/h12,14H,4-11H2,1-3H3
InChIKeyKTKVIOJGPBXXAU-UHFFFAOYSA-N
XLogP0.02
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1,4-diazepan-1-yl)-N-(2-methoxyethyl)-N-(2-methylpropyl)acetamide
CID 62837072
2-[2-methoxyethyl-(2-piperazin-1-ylacetyl)amino]acetic acid
CID 79271874
2-(4-aminopiperidin-1-yl)-N-(2-methoxyethyl)-N-(2-methylpropyl)acetamide
CID 79327783
methyl 3-[[2-(1,4-diazepan-1-yl)acetyl]-(2-methylpropyl)amino]propanoate
CID 62837257
2-(1,4-diazepan-1-yl)-N-(2-methoxyethyl)-N-pentan-3-ylacetamide
CID 62837792
4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)butanamide
CID 78884888
1-[2-methoxyethyl(2-methylpropyl)amino]-3-piperazin-1-ylpropan-2-ol
CID 65448121
N-(2-methoxyethyl)-N-(2-methylpropyl)carbamoyl chloride
CID 79886466
2-(cyclopentylamino)-N-(2-methoxyethyl)-N-(2-methylpropyl)acetamide
CID 54870876
N-cyclopropyl-2-(1,4-diazepan-1-yl)-N-(2-methylpropyl)acetamide
CID 62837604
[4-[2-[bis(2-methylpropyl)amino]-2-oxoethyl]-7,10-bis[[hydroxy(methyl)phosphoryl]methyl]-1,4,7,10-tetrazacyclododec-1-yl]methyl-methylphosphinic acid
CID 10461495
N-(2-hydroxyethyl)-2-piperazin-1-yl-N-propan-2-ylacetamide
CID 60851591

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide?
The IUPAC name of N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide (CID 54944353) is N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide?
The canonical SMILES for N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide is COCCN(CC(C)C)C(=O)CN1CCNCC1.
What is the InChIKey of N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide?
The InChIKey is KTKVIOJGPBXXAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O2/c1-12(2)10-16(8-9-18-3)13(17)11-15-6-4-14-5-7-15/h12,14H,4-11H2,1-3H3.
What are the key properties of N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide?
N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide has a molecular weight of 257.38 g/mol, XLogP of 0.02, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(2-methylpropyl)-2-piperazin-1-ylacetamide is sourced from PubChem (CID 54944353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).