1-(2-fluoropropyl)-4-propan-2-ylpiperidine

C11H22FN — CID 58394698

IUPAC1-(2-fluoropropyl)-4-propan-2-ylpiperidine
SMILESCC(F)CN1CCC(C(C)C)CC1
InChIInChI=1S/C11H22FN/c1-9(2)11-4-6-13(7-5-11)8-10(3)12/h9-11H,4-8H2,1-3H3
InChIKeyJVLFGHOVVOEUJB-UHFFFAOYSA-N
MW187.30 g/mol
LogP2.71
Rot. Bonds3

About 1-(2-fluoropropyl)-4-propan-2-ylpiperidine

1-(2-fluoropropyl)-4-propan-2-ylpiperidine (PubChem CID 58394698) has the molecular formula C11H22FN and a molecular weight of 187.30 g/mol. Its IUPAC name is 1-(2-fluoropropyl)-4-propan-2-ylpiperidine.

Molecular Properties

Compound Name1-(2-fluoropropyl)-4-propan-2-ylpiperidine
PubChem CID58394698
Molecular FormulaC11H22FN
Molecular Weight187.30 g/mol
Exact Mass187.17
IUPAC Name1-(2-fluoropropyl)-4-propan-2-ylpiperidine
SMILESCC(F)CN1CCC(C(C)C)CC1
InChIInChI=1S/C11H22FN/c1-9(2)11-4-6-13(7-5-11)8-10(3)12/h9-11H,4-8H2,1-3H3
InChIKeyJVLFGHOVVOEUJB-UHFFFAOYSA-N
XLogP2.71
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.30
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(2-fluoropropyl)-4-propan-2-ylpiperidine 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-(2-fluoropropyl)-4-propan-2-ylpiperidine?
The IUPAC name of 1-(2-fluoropropyl)-4-propan-2-ylpiperidine (CID 58394698) is 1-(2-fluoropropyl)-4-propan-2-ylpiperidine.
What is the SMILES notation for 1-(2-fluoropropyl)-4-propan-2-ylpiperidine?
The canonical SMILES for 1-(2-fluoropropyl)-4-propan-2-ylpiperidine is CC(F)CN1CCC(C(C)C)CC1.
What is the InChIKey of 1-(2-fluoropropyl)-4-propan-2-ylpiperidine?
The InChIKey is JVLFGHOVVOEUJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22FN/c1-9(2)11-4-6-13(7-5-11)8-10(3)12/h9-11H,4-8H2,1-3H3.
What are the key properties of 1-(2-fluoropropyl)-4-propan-2-ylpiperidine?
1-(2-fluoropropyl)-4-propan-2-ylpiperidine has a molecular weight of 187.30 g/mol, XLogP of 2.71, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoropropyl)-4-propan-2-ylpiperidine is sourced from PubChem (CID 58394698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).