2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine

C11H24N2O — CID 103227314

IUPAC2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine
SMILESCNCC(COC)N1CC(C)CC1C
InChIInChI=1S/C11H24N2O/c1-9-5-10(2)13(7-9)11(6-12-3)8-14-4/h9-12H,5-8H2,1-4H3
InChIKeyMGNJYLAKRRODSB-UHFFFAOYSA-N
MW200.33 g/mol
LogP0.95
Rot. Bonds5

About 2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine

2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine (PubChem CID 103227314) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine.

Molecular Properties

Compound Name2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine
PubChem CID103227314
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine
SMILESCNCC(COC)N1CC(C)CC1C
InChIInChI=1S/C11H24N2O/c1-9-5-10(2)13(7-9)11(6-12-3)8-14-4/h9-12H,5-8H2,1-4H3
InChIKeyMGNJYLAKRRODSB-UHFFFAOYSA-N
XLogP0.95
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine?
The IUPAC name of 2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine (CID 103227314) is 2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine.
What is the SMILES notation for 2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine?
The canonical SMILES for 2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine is CNCC(COC)N1CC(C)CC1C.
What is the InChIKey of 2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine?
The InChIKey is MGNJYLAKRRODSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-9-5-10(2)13(7-9)11(6-12-3)8-14-4/h9-12H,5-8H2,1-4H3.
What are the key properties of 2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine?
2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine has a molecular weight of 200.33 g/mol, XLogP of 0.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine is sourced from PubChem (CID 103227314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).