1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine

C12H24N2O — CID 61213513

IUPAC1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine
SMILESCOC1CNC(CN(C)C(C)C2CC2)C1
InChIInChI=1S/C12H24N2O/c1-9(10-4-5-10)14(2)8-11-6-12(15-3)7-13-11/h9-13H,4-8H2,1-3H3
InChIKeyJBIOQIPLUHZFBN-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.09
Rot. Bonds5

About 1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine

1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine (PubChem CID 61213513) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine
PubChem CID61213513
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine
SMILESCOC1CNC(CN(C)C(C)C2CC2)C1
InChIInChI=1S/C12H24N2O/c1-9(10-4-5-10)14(2)8-11-6-12(15-3)7-13-11/h9-13H,4-8H2,1-3H3
InChIKeyJBIOQIPLUHZFBN-UHFFFAOYSA-N
XLogP1.09
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine?
The IUPAC name of 1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine (CID 61213513) is 1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine?
The canonical SMILES for 1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine is COC1CNC(CN(C)C(C)C2CC2)C1.
What is the InChIKey of 1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine?
The InChIKey is JBIOQIPLUHZFBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-9(10-4-5-10)14(2)8-11-6-12(15-3)7-13-11/h9-13H,4-8H2,1-3H3.
What are the key properties of 1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine?
1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine has a molecular weight of 212.34 g/mol, XLogP of 1.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]-N-methylethanamine is sourced from PubChem (CID 61213513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).