N-fluoro-2H-pyran-2-amine

C5H6FNO — CID 175294788

IUPACN-fluoro-2H-pyran-2-amine
SMILESFNC1C=CC=CO1
InChIInChI=1S/C5H6FNO/c6-7-5-3-1-2-4-8-5/h1-5,7H
InChIKeyLGRZFILSRLJBNH-UHFFFAOYSA-N
MW115.11 g/mol
LogP0.89
Rot. Bonds1

About N-fluoro-2H-pyran-2-amine

N-fluoro-2H-pyran-2-amine (PubChem CID 175294788) has the molecular formula C5H6FNO and a molecular weight of 115.11 g/mol. Its IUPAC name is N-fluoro-2H-pyran-2-amine.

Molecular Properties

Compound NameN-fluoro-2H-pyran-2-amine
PubChem CID175294788
Molecular FormulaC5H6FNO
Molecular Weight115.11 g/mol
Exact Mass115.04
IUPAC NameN-fluoro-2H-pyran-2-amine
SMILESFNC1C=CC=CO1
InChIInChI=1S/C5H6FNO/c6-7-5-3-1-2-4-8-5/h1-5,7H
InChIKeyLGRZFILSRLJBNH-UHFFFAOYSA-N
XLogP0.89
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.11
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-fluoro-2H-pyran-2-amine?
The IUPAC name of N-fluoro-2H-pyran-2-amine (CID 175294788) is N-fluoro-2H-pyran-2-amine.
What is the SMILES notation for N-fluoro-2H-pyran-2-amine?
The canonical SMILES for N-fluoro-2H-pyran-2-amine is FNC1C=CC=CO1.
What is the InChIKey of N-fluoro-2H-pyran-2-amine?
The InChIKey is LGRZFILSRLJBNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6FNO/c6-7-5-3-1-2-4-8-5/h1-5,7H.
What are the key properties of N-fluoro-2H-pyran-2-amine?
N-fluoro-2H-pyran-2-amine has a molecular weight of 115.11 g/mol, XLogP of 0.89, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-fluoro-2H-pyran-2-amine is sourced from PubChem (CID 175294788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).