4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine

C15H30N2O — CID 130207405

IUPAC4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine
SMILESCCCC1COCCN1CC(C)CC1CCCN1
InChIInChI=1S/C15H30N2O/c1-3-5-15-12-18-9-8-17(15)11-13(2)10-14-6-4-7-16-14/h13-16H,3-12H2,1-2H3
InChIKeyIRAKZHMYBWVBKG-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.27
Rot. Bonds6

About 4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine

4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine (PubChem CID 130207405) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine.

Molecular Properties

Compound Name4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine
PubChem CID130207405
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine
SMILESCCCC1COCCN1CC(C)CC1CCCN1
InChIInChI=1S/C15H30N2O/c1-3-5-15-12-18-9-8-17(15)11-13(2)10-14-6-4-7-16-14/h13-16H,3-12H2,1-2H3
InChIKeyIRAKZHMYBWVBKG-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine?
The IUPAC name of 4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine (CID 130207405) is 4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine.
What is the SMILES notation for 4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine?
The canonical SMILES for 4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine is CCCC1COCCN1CC(C)CC1CCCN1.
What is the InChIKey of 4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine?
The InChIKey is IRAKZHMYBWVBKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-5-15-12-18-9-8-17(15)11-13(2)10-14-6-4-7-16-14/h13-16H,3-12H2,1-2H3.
What are the key properties of 4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine?
4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine has a molecular weight of 254.42 g/mol, XLogP of 2.27, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methyl-3-pyrrolidin-2-ylpropyl)-3-propylmorpholine is sourced from PubChem (CID 130207405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).