N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine

C11H25N3 — CID 83619171

IUPACN,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine
SMILESCCN(CC)CCC1CN(C)CCN1
InChIInChI=1S/C11H25N3/c1-4-14(5-2)8-6-11-10-13(3)9-7-12-11/h11-12H,4-10H2,1-3H3
InChIKeyJZCDDEODPRCHQF-UHFFFAOYSA-N
MW199.34 g/mol
LogP0.62
Rot. Bonds5

About N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine

N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine (PubChem CID 83619171) has the molecular formula C11H25N3 and a molecular weight of 199.34 g/mol. Its IUPAC name is N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine.

Molecular Properties

Compound NameN,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine
PubChem CID83619171
Molecular FormulaC11H25N3
Molecular Weight199.34 g/mol
Exact Mass199.20
IUPAC NameN,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine
SMILESCCN(CC)CCC1CN(C)CCN1
InChIInChI=1S/C11H25N3/c1-4-14(5-2)8-6-11-10-13(3)9-7-12-11/h11-12H,4-10H2,1-3H3
InChIKeyJZCDDEODPRCHQF-UHFFFAOYSA-N
XLogP0.62
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine?
The IUPAC name of N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine (CID 83619171) is N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine.
What is the SMILES notation for N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine?
The canonical SMILES for N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine is CCN(CC)CCC1CN(C)CCN1.
What is the InChIKey of N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine?
The InChIKey is JZCDDEODPRCHQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3/c1-4-14(5-2)8-6-11-10-13(3)9-7-12-11/h11-12H,4-10H2,1-3H3.
What are the key properties of N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine?
N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine has a molecular weight of 199.34 g/mol, XLogP of 0.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine is sourced from PubChem (CID 83619171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).