1-(2,2-dimethoxyethyl)-4-ethylpiperazine

C10H22N2O2 — CID 66221021

IUPAC1-(2,2-dimethoxyethyl)-4-ethylpiperazine
SMILESCCN1CCN(CC(OC)OC)CC1
InChIInChI=1S/C10H22N2O2/c1-4-11-5-7-12(8-6-11)9-10(13-2)14-3/h10H,4-9H2,1-3H3
InChIKeySHBHKSSDFZPIGX-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.24
Rot. Bonds5

About 1-(2,2-dimethoxyethyl)-4-ethylpiperazine

1-(2,2-dimethoxyethyl)-4-ethylpiperazine (PubChem CID 66221021) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-(2,2-dimethoxyethyl)-4-ethylpiperazine.

Molecular Properties

Compound Name1-(2,2-dimethoxyethyl)-4-ethylpiperazine
PubChem CID66221021
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name1-(2,2-dimethoxyethyl)-4-ethylpiperazine
SMILESCCN1CCN(CC(OC)OC)CC1
InChIInChI=1S/C10H22N2O2/c1-4-11-5-7-12(8-6-11)9-10(13-2)14-3/h10H,4-9H2,1-3H3
InChIKeySHBHKSSDFZPIGX-UHFFFAOYSA-N
XLogP0.24
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-Morpholinoacetaldehyde diethylacetal
CID 248492
1-(2,2-Diethoxyethyl)piperazine
CID 2737392
1-(Dimethoxymethyl)-4-methylpiperazine
CID 13117361
2-(4-(2,2-Diethoxyethyl)piperazin-1-yl)ethan-1-ol
CID 63617658
1-(2,2-Diethoxyethyl)-4-methylpiperazine
CID 63618525
N,N-diethyl-2-[4-(2-methoxyethyl)piperazin-1-yl]ethanamine
CID 68265802
1-(2,2-Dimethoxyethyl)piperazine
CID 45099607
1-(1,1-Dimethoxyethyl)-4-methylpiperazine
CID 71404446
1,4-Bis(2-ethoxyethyl)piperazine
CID 203470
1,4-Bis(2-methoxyethyl)piperazine
CID 13598995
2-[4-(2-Methoxyethyl)piperazin-1-yl]ethyl hypofluorite
CID 142368077
1-(1,1-Dimethoxyethyl)-4-ethylpiperazine
CID 134891732

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethoxyethyl)-4-ethylpiperazine?
The IUPAC name of 1-(2,2-dimethoxyethyl)-4-ethylpiperazine (CID 66221021) is 1-(2,2-dimethoxyethyl)-4-ethylpiperazine.
What is the SMILES notation for 1-(2,2-dimethoxyethyl)-4-ethylpiperazine?
The canonical SMILES for 1-(2,2-dimethoxyethyl)-4-ethylpiperazine is CCN1CCN(CC(OC)OC)CC1.
What is the InChIKey of 1-(2,2-dimethoxyethyl)-4-ethylpiperazine?
The InChIKey is SHBHKSSDFZPIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-4-11-5-7-12(8-6-11)9-10(13-2)14-3/h10H,4-9H2,1-3H3.
What are the key properties of 1-(2,2-dimethoxyethyl)-4-ethylpiperazine?
1-(2,2-dimethoxyethyl)-4-ethylpiperazine has a molecular weight of 202.30 g/mol, XLogP of 0.24, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethoxyethyl)-4-ethylpiperazine is sourced from PubChem (CID 66221021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).