N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine

C6H7FN2O — CID 70384651

IUPACN-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine
SMILESFC=CCNc1ccon1
InChIInChI=1S/C6H7FN2O/c7-3-1-4-8-6-2-5-10-9-6/h1-3,5H,4H2,(H,8,9)
InChIKeyMLKNHSPNUVQRAK-UHFFFAOYSA-N
MW142.13 g/mol
LogP1.57
Rot. Bonds3

About N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine

N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine (PubChem CID 70384651) has the molecular formula C6H7FN2O and a molecular weight of 142.13 g/mol. Its IUPAC name is N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound NameN-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine
PubChem CID70384651
Molecular FormulaC6H7FN2O
Molecular Weight142.13 g/mol
Exact Mass142.05
IUPAC NameN-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine
SMILESFC=CCNc1ccon1
InChIInChI=1S/C6H7FN2O/c7-3-1-4-8-6-2-5-10-9-6/h1-3,5H,4H2,(H,8,9)
InChIKeyMLKNHSPNUVQRAK-UHFFFAOYSA-N
XLogP1.57
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.13
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine?
The IUPAC name of N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine (CID 70384651) is N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine.
What is the SMILES notation for N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine?
The canonical SMILES for N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine is FC=CCNc1ccon1.
What is the InChIKey of N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine?
The InChIKey is MLKNHSPNUVQRAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2O/c7-3-1-4-8-6-2-5-10-9-6/h1-3,5H,4H2,(H,8,9).
What are the key properties of N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine?
N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine has a molecular weight of 142.13 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 70384651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).