[5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine

C5H7FN2O — CID 84762287

IUPAC[5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine
SMILESNCc1ncc(CF)o1
InChIInChI=1S/C5H7FN2O/c6-1-4-3-8-5(2-7)9-4/h3H,1-2,7H2
InChIKeyFWNFVCJLCMHBGM-UHFFFAOYSA-N
MW130.12 g/mol
LogP0.60
Rot. Bonds2

About [5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine

[5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine (PubChem CID 84762287) has the molecular formula C5H7FN2O and a molecular weight of 130.12 g/mol. Its IUPAC name is [5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine.

Molecular Properties

Compound Name[5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine
PubChem CID84762287
Molecular FormulaC5H7FN2O
Molecular Weight130.12 g/mol
Exact Mass130.05
IUPAC Name[5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine
SMILESNCc1ncc(CF)o1
InChIInChI=1S/C5H7FN2O/c6-1-4-3-8-5(2-7)9-4/h3H,1-2,7H2
InChIKeyFWNFVCJLCMHBGM-UHFFFAOYSA-N
XLogP0.60
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.12
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine?
The IUPAC name of [5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine (CID 84762287) is [5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine.
What is the SMILES notation for [5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine?
The canonical SMILES for [5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine is NCc1ncc(CF)o1.
What is the InChIKey of [5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine?
The InChIKey is FWNFVCJLCMHBGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7FN2O/c6-1-4-3-8-5(2-7)9-4/h3H,1-2,7H2.
What are the key properties of [5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine?
[5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine has a molecular weight of 130.12 g/mol, XLogP of 0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(fluoromethyl)-1,3-oxazol-2-yl]methanamine is sourced from PubChem (CID 84762287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).