2-fluoropiperidin-1-amine

C5H11FN2 — CID 141108449

IUPAC2-fluoropiperidin-1-amine
SMILESNN1CCCCC1F
InChIInChI=1S/C5H11FN2/c6-5-3-1-2-4-8(5)7/h5H,1-4,7H2
InChIKeyRJVZNOBSSCOJBH-UHFFFAOYSA-N
MW118.16 g/mol
LogP0.64
Rot. Bonds

About 2-fluoropiperidin-1-amine

2-fluoropiperidin-1-amine (PubChem CID 141108449) has the molecular formula C5H11FN2 and a molecular weight of 118.16 g/mol. Its IUPAC name is 2-fluoropiperidin-1-amine.

Molecular Properties

Compound Name2-fluoropiperidin-1-amine
PubChem CID141108449
Molecular FormulaC5H11FN2
Molecular Weight118.16 g/mol
Exact Mass118.09
IUPAC Name2-fluoropiperidin-1-amine
SMILESNN1CCCCC1F
InChIInChI=1S/C5H11FN2/c6-5-3-1-2-4-8(5)7/h5H,1-4,7H2
InChIKeyRJVZNOBSSCOJBH-UHFFFAOYSA-N
XLogP0.64
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.16
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-fluoropiperidin-1-amine?
The IUPAC name of 2-fluoropiperidin-1-amine (CID 141108449) is 2-fluoropiperidin-1-amine.
What is the SMILES notation for 2-fluoropiperidin-1-amine?
The canonical SMILES for 2-fluoropiperidin-1-amine is NN1CCCCC1F.
What is the InChIKey of 2-fluoropiperidin-1-amine?
The InChIKey is RJVZNOBSSCOJBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11FN2/c6-5-3-1-2-4-8(5)7/h5H,1-4,7H2.
What are the key properties of 2-fluoropiperidin-1-amine?
2-fluoropiperidin-1-amine has a molecular weight of 118.16 g/mol, XLogP of 0.64, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoropiperidin-1-amine is sourced from PubChem (CID 141108449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).