2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine

C10H23N3O — CID 117003769

IUPAC2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine
SMILESCOCC1CNCCN1CCN(C)C
InChIInChI=1S/C10H23N3O/c1-12(2)6-7-13-5-4-11-8-10(13)9-14-3/h10-11H,4-9H2,1-3H3
InChIKeyJIDCQYSVEAGWBA-UHFFFAOYSA-N
MW201.31 g/mol
LogP-0.53
Rot. Bonds5

About 2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine

2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine (PubChem CID 117003769) has the molecular formula C10H23N3O and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine
PubChem CID117003769
Molecular FormulaC10H23N3O
Molecular Weight201.31 g/mol
Exact Mass201.18
IUPAC Name2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine
SMILESCOCC1CNCCN1CCN(C)C
InChIInChI=1S/C10H23N3O/c1-12(2)6-7-13-5-4-11-8-10(13)9-14-3/h10-11H,4-9H2,1-3H3
InChIKeyJIDCQYSVEAGWBA-UHFFFAOYSA-N
XLogP-0.53
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 5-0.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine?
The IUPAC name of 2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine (CID 117003769) is 2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine?
The canonical SMILES for 2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine is COCC1CNCCN1CCN(C)C.
What is the InChIKey of 2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine?
The InChIKey is JIDCQYSVEAGWBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O/c1-12(2)6-7-13-5-4-11-8-10(13)9-14-3/h10-11H,4-9H2,1-3H3.
What are the key properties of 2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine?
2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine has a molecular weight of 201.31 g/mol, XLogP of -0.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine is sourced from PubChem (CID 117003769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).