1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine

C13H24N2O — CID 61480574

IUPAC1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine
SMILESCOC1CNC(CNC(C2CC2)C2CC2)C1
InChIInChI=1S/C13H24N2O/c1-16-12-6-11(14-8-12)7-15-13(9-2-3-9)10-4-5-10/h9-15H,2-8H2,1H3
InChIKeyCPNPAFOPSDPYLI-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.14
Rot. Bonds6

About 1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine

1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine (PubChem CID 61480574) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine.

Molecular Properties

Compound Name1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine
PubChem CID61480574
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine
SMILESCOC1CNC(CNC(C2CC2)C2CC2)C1
InChIInChI=1S/C13H24N2O/c1-16-12-6-11(14-8-12)7-15-13(9-2-3-9)10-4-5-10/h9-15H,2-8H2,1H3
InChIKeyCPNPAFOPSDPYLI-UHFFFAOYSA-N
XLogP1.14
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine?
The IUPAC name of 1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine (CID 61480574) is 1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine.
What is the SMILES notation for 1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine?
The canonical SMILES for 1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine is COC1CNC(CNC(C2CC2)C2CC2)C1.
What is the InChIKey of 1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine?
The InChIKey is CPNPAFOPSDPYLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-16-12-6-11(14-8-12)7-15-13(9-2-3-9)10-4-5-10/h9-15H,2-8H2,1H3.
What are the key properties of 1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine?
1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine has a molecular weight of 224.35 g/mol, XLogP of 1.14, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dicyclopropyl-N-[(4-methoxypyrrolidin-2-yl)methyl]methanamine is sourced from PubChem (CID 61480574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).