N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine

C12H26N2O — CID 58826569

IUPACN-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine
SMILESCCN(C)CCN1CCC(COC)CC1
InChIInChI=1S/C12H26N2O/c1-4-13(2)9-10-14-7-5-12(6-8-14)11-15-3/h12H,4-11H2,1-3H3
InChIKeyKWBINROBSPIVMD-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.30
Rot. Bonds6

About N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine

N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine (PubChem CID 58826569) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine.

Molecular Properties

Compound NameN-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine
PubChem CID58826569
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine
SMILESCCN(C)CCN1CCC(COC)CC1
InChIInChI=1S/C12H26N2O/c1-4-13(2)9-10-14-7-5-12(6-8-14)11-15-3/h12H,4-11H2,1-3H3
InChIKeyKWBINROBSPIVMD-UHFFFAOYSA-N
XLogP1.30
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.30
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-(methoxymethyl)piperidin-1-yl]-N-methylethanamine?
The IUPAC name of N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine (CID 58826569) is N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine.
What is the SMILES notation for N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine?
The canonical SMILES for N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine is CCN(C)CCN1CCC(COC)CC1.
What is the InChIKey of N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine?
The InChIKey is KWBINROBSPIVMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-13(2)9-10-14-7-5-12(6-8-14)11-15-3/h12H,4-11H2,1-3H3.
What are the key properties of N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine?
N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine has a molecular weight of 214.35 g/mol, XLogP of 1.30, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine is sourced from PubChem (CID 58826569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).