N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine

C11H22FN3 — CID 105469167

IUPACN-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine
SMILESNC1CCC(F)(CNC2CCNCC2)C1
InChIInChI=1S/C11H22FN3/c12-11(4-1-9(13)7-11)8-15-10-2-5-14-6-3-10/h9-10,14-15H,1-8,13H2
InChIKeyVBGGAAZFCUYTPU-UHFFFAOYSA-N
MW215.32 g/mol
LogP0.55
Rot. Bonds3

About N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine

N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine (PubChem CID 105469167) has the molecular formula C11H22FN3 and a molecular weight of 215.32 g/mol. Its IUPAC name is N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine.

Molecular Properties

Compound NameN-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine
PubChem CID105469167
Molecular FormulaC11H22FN3
Molecular Weight215.32 g/mol
Exact Mass215.18
IUPAC NameN-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine
SMILESNC1CCC(F)(CNC2CCNCC2)C1
InChIInChI=1S/C11H22FN3/c12-11(4-1-9(13)7-11)8-15-10-2-5-14-6-3-10/h9-10,14-15H,1-8,13H2
InChIKeyVBGGAAZFCUYTPU-UHFFFAOYSA-N
XLogP0.55
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 50.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine 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 N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine?
The IUPAC name of N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine (CID 105469167) is N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine.
What is the SMILES notation for N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine?
The canonical SMILES for N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine is NC1CCC(F)(CNC2CCNCC2)C1.
What is the InChIKey of N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine?
The InChIKey is VBGGAAZFCUYTPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22FN3/c12-11(4-1-9(13)7-11)8-15-10-2-5-14-6-3-10/h9-10,14-15H,1-8,13H2.
What are the key properties of N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine?
N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine has a molecular weight of 215.32 g/mol, XLogP of 0.55, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-amino-1-fluorocyclopentyl)methyl]piperidin-4-amine is sourced from PubChem (CID 105469167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).