1-methyl-4-pyrrolidin-3-yloxypiperidine

C10H20N2O — CID 117046275

IUPAC1-methyl-4-pyrrolidin-3-yloxypiperidine
SMILESCN1CCC(OC2CCNC2)CC1
InChIInChI=1S/C10H20N2O/c1-12-6-3-9(4-7-12)13-10-2-5-11-8-10/h9-11H,2-8H2,1H3
InChIKeyFOFLBPLTBITLGX-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.46
Rot. Bonds2

About 1-methyl-4-pyrrolidin-3-yloxypiperidine

1-methyl-4-pyrrolidin-3-yloxypiperidine (PubChem CID 117046275) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-methyl-4-pyrrolidin-3-yloxypiperidine.

Molecular Properties

Compound Name1-methyl-4-pyrrolidin-3-yloxypiperidine
PubChem CID117046275
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-methyl-4-pyrrolidin-3-yloxypiperidine
SMILESCN1CCC(OC2CCNC2)CC1
InChIInChI=1S/C10H20N2O/c1-12-6-3-9(4-7-12)13-10-2-5-11-8-10/h9-11H,2-8H2,1H3
InChIKeyFOFLBPLTBITLGX-UHFFFAOYSA-N
XLogP0.46
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-pyrrolidin-3-yloxypiperidine?
The IUPAC name of 1-methyl-4-pyrrolidin-3-yloxypiperidine (CID 117046275) is 1-methyl-4-pyrrolidin-3-yloxypiperidine.
What is the SMILES notation for 1-methyl-4-pyrrolidin-3-yloxypiperidine?
The canonical SMILES for 1-methyl-4-pyrrolidin-3-yloxypiperidine is CN1CCC(OC2CCNC2)CC1.
What is the InChIKey of 1-methyl-4-pyrrolidin-3-yloxypiperidine?
The InChIKey is FOFLBPLTBITLGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-12-6-3-9(4-7-12)13-10-2-5-11-8-10/h9-11H,2-8H2,1H3.
What are the key properties of 1-methyl-4-pyrrolidin-3-yloxypiperidine?
1-methyl-4-pyrrolidin-3-yloxypiperidine has a molecular weight of 184.28 g/mol, XLogP of 0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-pyrrolidin-3-yloxypiperidine is sourced from PubChem (CID 117046275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).