2-fluoro-N-methylpiperidin-4-amine

C6H13FN2 — CID 154694551

IUPAC2-fluoro-N-methylpiperidin-4-amine
SMILESCNC1CCNC(F)C1
InChIInChI=1S/C6H13FN2/c1-8-5-2-3-9-6(7)4-5/h5-6,8-9H,2-4H2,1H3
InChIKeyNFFMDPIJIPJFBU-UHFFFAOYSA-N
MW132.18 g/mol
LogP0.25
Rot. Bonds1

About 2-fluoro-N-methylpiperidin-4-amine

2-fluoro-N-methylpiperidin-4-amine (PubChem CID 154694551) has the molecular formula C6H13FN2 and a molecular weight of 132.18 g/mol. Its IUPAC name is 2-fluoro-N-methylpiperidin-4-amine.

Molecular Properties

Compound Name2-fluoro-N-methylpiperidin-4-amine
PubChem CID154694551
Molecular FormulaC6H13FN2
Molecular Weight132.18 g/mol
Exact Mass132.11
IUPAC Name2-fluoro-N-methylpiperidin-4-amine
SMILESCNC1CCNC(F)C1
InChIInChI=1S/C6H13FN2/c1-8-5-2-3-9-6(7)4-5/h5-6,8-9H,2-4H2,1H3
InChIKeyNFFMDPIJIPJFBU-UHFFFAOYSA-N
XLogP0.25
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.18
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-methylpiperidin-4-amine?
The IUPAC name of 2-fluoro-N-methylpiperidin-4-amine (CID 154694551) is 2-fluoro-N-methylpiperidin-4-amine.
What is the SMILES notation for 2-fluoro-N-methylpiperidin-4-amine?
The canonical SMILES for 2-fluoro-N-methylpiperidin-4-amine is CNC1CCNC(F)C1.
What is the InChIKey of 2-fluoro-N-methylpiperidin-4-amine?
The InChIKey is NFFMDPIJIPJFBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13FN2/c1-8-5-2-3-9-6(7)4-5/h5-6,8-9H,2-4H2,1H3.
What are the key properties of 2-fluoro-N-methylpiperidin-4-amine?
2-fluoro-N-methylpiperidin-4-amine has a molecular weight of 132.18 g/mol, XLogP of 0.25, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-methylpiperidin-4-amine is sourced from PubChem (CID 154694551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).