2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine

C12H26N2O — CID 134605487

IUPAC2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine
SMILESCOCC1CCC(C)N1C(C)CN(C)C
InChIInChI=1S/C12H26N2O/c1-10-6-7-12(9-15-5)14(10)11(2)8-13(3)4/h10-12H,6-9H2,1-5H3
InChIKeyOSYNXTRMABOCIB-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.44
Rot. Bonds5

About 2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine

2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine (PubChem CID 134605487) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine
PubChem CID134605487
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine
SMILESCOCC1CCC(C)N1C(C)CN(C)C
InChIInChI=1S/C12H26N2O/c1-10-6-7-12(9-15-5)14(10)11(2)8-13(3)4/h10-12H,6-9H2,1-5H3
InChIKeyOSYNXTRMABOCIB-UHFFFAOYSA-N
XLogP1.44
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine?
The IUPAC name of 2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine (CID 134605487) is 2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine?
The canonical SMILES for 2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine is COCC1CCC(C)N1C(C)CN(C)C.
What is the InChIKey of 2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine?
The InChIKey is OSYNXTRMABOCIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-10-6-7-12(9-15-5)14(10)11(2)8-13(3)4/h10-12H,6-9H2,1-5H3.
What are the key properties of 2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine?
2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.44, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methoxymethyl)-5-methylpyrrolidin-1-yl]-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 134605487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).