N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine

C13H29N3O — CID 80551240

IUPACN-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine
SMILESCCN(CCOC)CC(C)(C)N1CCNCC1
InChIInChI=1S/C13H29N3O/c1-5-15(10-11-17-4)12-13(2,3)16-8-6-14-7-9-16/h14H,5-12H2,1-4H3
InChIKeyJWCGSLPEGIOPJB-UHFFFAOYSA-N
MW243.39 g/mol
LogP0.64
Rot. Bonds7

About N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine

N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine (PubChem CID 80551240) has the molecular formula C13H29N3O and a molecular weight of 243.39 g/mol. Its IUPAC name is N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine
PubChem CID80551240
Molecular FormulaC13H29N3O
Molecular Weight243.39 g/mol
Exact Mass243.23
IUPAC NameN-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine
SMILESCCN(CCOC)CC(C)(C)N1CCNCC1
InChIInChI=1S/C13H29N3O/c1-5-15(10-11-17-4)12-13(2,3)16-8-6-14-7-9-16/h14H,5-12H2,1-4H3
InChIKeyJWCGSLPEGIOPJB-UHFFFAOYSA-N
XLogP0.64
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine?
The IUPAC name of N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine (CID 80551240) is N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine.
What is the SMILES notation for N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine?
The canonical SMILES for N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine is CCN(CCOC)CC(C)(C)N1CCNCC1.
What is the InChIKey of N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine?
The InChIKey is JWCGSLPEGIOPJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3O/c1-5-15(10-11-17-4)12-13(2,3)16-8-6-14-7-9-16/h14H,5-12H2,1-4H3.
What are the key properties of N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine?
N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine has a molecular weight of 243.39 g/mol, XLogP of 0.64, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methoxyethyl)-2-methyl-2-piperazin-1-ylpropan-1-amine is sourced from PubChem (CID 80551240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).