5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine

C8H18N2O — CID 20705157

IUPAC5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine
SMILESCNC1CC(COC)N(C)C1
InChIInChI=1S/C8H18N2O/c1-9-7-4-8(6-11-3)10(2)5-7/h7-9H,4-6H2,1-3H3
InChIKeyZTSKEESALDFRPK-UHFFFAOYSA-N
MW158.24 g/mol
LogP-0.08
Rot. Bonds3

About 5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine

5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine (PubChem CID 20705157) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine
PubChem CID20705157
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine
SMILESCNC1CC(COC)N(C)C1
InChIInChI=1S/C8H18N2O/c1-9-7-4-8(6-11-3)10(2)5-7/h7-9H,4-6H2,1-3H3
InChIKeyZTSKEESALDFRPK-UHFFFAOYSA-N
XLogP-0.08
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine?
The IUPAC name of 5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine (CID 20705157) is 5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine.
What is the SMILES notation for 5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine?
The canonical SMILES for 5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine is CNC1CC(COC)N(C)C1.
What is the InChIKey of 5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine?
The InChIKey is ZTSKEESALDFRPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-9-7-4-8(6-11-3)10(2)5-7/h7-9H,4-6H2,1-3H3.
What are the key properties of 5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine?
5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine has a molecular weight of 158.24 g/mol, XLogP of -0.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-N,1-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 20705157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).