1-(1-fluorocyclohexyl)pyrrolidine

C10H18FN — CID 22321170

IUPAC1-(1-fluorocyclohexyl)pyrrolidine
SMILESFC1(N2CCCC2)CCCCC1
InChIInChI=1S/C10H18FN/c11-10(6-2-1-3-7-10)12-8-4-5-9-12/h1-9H2
InChIKeyKJUZKVAIERCJSZ-UHFFFAOYSA-N
MW171.26 g/mol
LogP2.71
Rot. Bonds1

About 1-(1-fluorocyclohexyl)pyrrolidine

1-(1-fluorocyclohexyl)pyrrolidine (PubChem CID 22321170) has the molecular formula C10H18FN and a molecular weight of 171.26 g/mol. Its IUPAC name is 1-(1-fluorocyclohexyl)pyrrolidine.

Molecular Properties

Compound Name1-(1-fluorocyclohexyl)pyrrolidine
PubChem CID22321170
Molecular FormulaC10H18FN
Molecular Weight171.26 g/mol
Exact Mass171.14
IUPAC Name1-(1-fluorocyclohexyl)pyrrolidine
SMILESFC1(N2CCCC2)CCCCC1
InChIInChI=1S/C10H18FN/c11-10(6-2-1-3-7-10)12-8-4-5-9-12/h1-9H2
InChIKeyKJUZKVAIERCJSZ-UHFFFAOYSA-N
XLogP2.71
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.26
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze 1-(1-fluorocyclohexyl)pyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(1-fluorocyclohexyl)pyrrolidine?
The IUPAC name of 1-(1-fluorocyclohexyl)pyrrolidine (CID 22321170) is 1-(1-fluorocyclohexyl)pyrrolidine.
What is the SMILES notation for 1-(1-fluorocyclohexyl)pyrrolidine?
The canonical SMILES for 1-(1-fluorocyclohexyl)pyrrolidine is FC1(N2CCCC2)CCCCC1.
What is the InChIKey of 1-(1-fluorocyclohexyl)pyrrolidine?
The InChIKey is KJUZKVAIERCJSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FN/c11-10(6-2-1-3-7-10)12-8-4-5-9-12/h1-9H2.
What are the key properties of 1-(1-fluorocyclohexyl)pyrrolidine?
1-(1-fluorocyclohexyl)pyrrolidine has a molecular weight of 171.26 g/mol, XLogP of 2.71, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-fluorocyclohexyl)pyrrolidine is sourced from PubChem (CID 22321170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).