3-cyclohexyloxy-1-methylpyrrolidine

C11H21NO — CID 18723140

IUPAC3-cyclohexyloxy-1-methylpyrrolidine
SMILESCN1CCC(OC2CCCCC2)C1
InChIInChI=1S/C11H21NO/c1-12-8-7-11(9-12)13-10-5-3-2-4-6-10/h10-11H,2-9H2,1H3
InChIKeyGCINGURTNOAHOH-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.04
Rot. Bonds2

About 3-cyclohexyloxy-1-methylpyrrolidine

3-cyclohexyloxy-1-methylpyrrolidine (PubChem CID 18723140) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 3-cyclohexyloxy-1-methylpyrrolidine.

Molecular Properties

Compound Name3-cyclohexyloxy-1-methylpyrrolidine
PubChem CID18723140
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name3-cyclohexyloxy-1-methylpyrrolidine
SMILESCN1CCC(OC2CCCCC2)C1
InChIInChI=1S/C11H21NO/c1-12-8-7-11(9-12)13-10-5-3-2-4-6-10/h10-11H,2-9H2,1H3
InChIKeyGCINGURTNOAHOH-UHFFFAOYSA-N
XLogP2.04
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyloxy-1-methylpyrrolidine?
The IUPAC name of 3-cyclohexyloxy-1-methylpyrrolidine (CID 18723140) is 3-cyclohexyloxy-1-methylpyrrolidine.
What is the SMILES notation for 3-cyclohexyloxy-1-methylpyrrolidine?
The canonical SMILES for 3-cyclohexyloxy-1-methylpyrrolidine is CN1CCC(OC2CCCCC2)C1.
What is the InChIKey of 3-cyclohexyloxy-1-methylpyrrolidine?
The InChIKey is GCINGURTNOAHOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-12-8-7-11(9-12)13-10-5-3-2-4-6-10/h10-11H,2-9H2,1H3.
What are the key properties of 3-cyclohexyloxy-1-methylpyrrolidine?
3-cyclohexyloxy-1-methylpyrrolidine has a molecular weight of 183.29 g/mol, XLogP of 2.04, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyloxy-1-methylpyrrolidine is sourced from PubChem (CID 18723140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).