N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine

C11H25N3 — CID 168923130

IUPACN-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine
SMILESCCN(C)CCN1CCN(CC)CC1
InChIInChI=1S/C11H25N3/c1-4-12(3)6-7-14-10-8-13(5-2)9-11-14/h4-11H2,1-3H3
InChIKeyVXHKSZZSJHHRSY-UHFFFAOYSA-N
MW199.34 g/mol
LogP0.58
Rot. Bonds5

About N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine

N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine (PubChem CID 168923130) has the molecular formula C11H25N3 and a molecular weight of 199.34 g/mol. Its IUPAC name is N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine.

Molecular Properties

Compound NameN-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine
PubChem CID168923130
Molecular FormulaC11H25N3
Molecular Weight199.34 g/mol
Exact Mass199.20
IUPAC NameN-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine
SMILESCCN(C)CCN1CCN(CC)CC1
InChIInChI=1S/C11H25N3/c1-4-12(3)6-7-14-10-8-13(5-2)9-11-14/h4-11H2,1-3H3
InChIKeyVXHKSZZSJHHRSY-UHFFFAOYSA-N
XLogP0.58
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine?
The IUPAC name of N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine (CID 168923130) is N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine.
What is the SMILES notation for N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine?
The canonical SMILES for N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine is CCN(C)CCN1CCN(CC)CC1.
What is the InChIKey of N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine?
The InChIKey is VXHKSZZSJHHRSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3/c1-4-12(3)6-7-14-10-8-13(5-2)9-11-14/h4-11H2,1-3H3.
What are the key properties of N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine?
N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine has a molecular weight of 199.34 g/mol, XLogP of 0.58, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-ethylpiperazin-1-yl)-N-methylethanamine is sourced from PubChem (CID 168923130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).