1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine

C11H21NO — CID 146397828

IUPAC1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine
SMILESCC(C)OCC1CCN(C2CC2)C1
InChIInChI=1S/C11H21NO/c1-9(2)13-8-10-5-6-12(7-10)11-3-4-11/h9-11H,3-8H2,1-2H3
InChIKeyIZLNICFHYJSQOO-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.90
Rot. Bonds4

About 1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine

1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine (PubChem CID 146397828) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine.

Molecular Properties

Compound Name1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine
PubChem CID146397828
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine
SMILESCC(C)OCC1CCN(C2CC2)C1
InChIInChI=1S/C11H21NO/c1-9(2)13-8-10-5-6-12(7-10)11-3-4-11/h9-11H,3-8H2,1-2H3
InChIKeyIZLNICFHYJSQOO-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine?
The IUPAC name of 1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine (CID 146397828) is 1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine.
What is the SMILES notation for 1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine?
The canonical SMILES for 1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine is CC(C)OCC1CCN(C2CC2)C1.
What is the InChIKey of 1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine?
The InChIKey is IZLNICFHYJSQOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(2)13-8-10-5-6-12(7-10)11-3-4-11/h9-11H,3-8H2,1-2H3.
What are the key properties of 1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine?
1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine has a molecular weight of 183.29 g/mol, XLogP of 1.90, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(propan-2-yloxymethyl)pyrrolidine is sourced from PubChem (CID 146397828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).