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

C6H9FN2O — CID 84762832

IUPAC1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine
SMILESCC(N)c1cnc(CF)o1
InChIInChI=1S/C6H9FN2O/c1-4(8)5-3-9-6(2-7)10-5/h3-4H,2,8H2,1H3
InChIKeyPMEDONHXPNNPDG-UHFFFAOYSA-N
MW144.15 g/mol
LogP1.16
Rot. Bonds2

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

1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine (PubChem CID 84762832) has the molecular formula C6H9FN2O and a molecular weight of 144.15 g/mol. Its IUPAC name is 1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine.

Molecular Properties

Compound Name1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine
PubChem CID84762832
Molecular FormulaC6H9FN2O
Molecular Weight144.15 g/mol
Exact Mass144.07
IUPAC Name1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine
SMILESCC(N)c1cnc(CF)o1
InChIInChI=1S/C6H9FN2O/c1-4(8)5-3-9-6(2-7)10-5/h3-4H,2,8H2,1H3
InChIKeyPMEDONHXPNNPDG-UHFFFAOYSA-N
XLogP1.16
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.15
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-Ethyl-2-methyloxazole
CID 528407
N-{[5-(propan-2-yl)-1,3-oxazol-2-yl]methyl}-N-(pyrrolidin-3-yl)acetamide
CID 71873201
(2-Methyl-1,3-oxazol-5-yl)methanamine
CID 19105071
1-(5-Methyl-1,3-oxazol-2-yl)ethan-1-amine
CID 24255020
2-(2-Methyl-1,3-oxazol-5-yl)acetonitrile
CID 44119609
[5-(Propan-2-yl)-1,3-oxazol-2-yl]methanamine
CID 54594018
(5-Ethyl-1,3-oxazol-2-yl)methanamine
CID 65180193
(2-Ethyl-1,3-oxazol-5-yl)methanamine
CID 82074647
1-(2-Tert-butyl-1,3-oxazol-5-yl)methanamine
CID 82074678
2,5-Diethyloxazole
CID 3016237
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-(pyrrolidin-3-yl)acetamide hydrochloride
CID 71756632
(2-Cyclopropyl-1,3-oxazol-5-yl)methanamine
CID 82074651

Frequently Asked Questions

What is the IUPAC name of 1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine?
The IUPAC name of 1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine (CID 84762832) is 1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine.
What is the SMILES notation for 1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine?
The canonical SMILES for 1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine is CC(N)c1cnc(CF)o1.
What is the InChIKey of 1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine?
The InChIKey is PMEDONHXPNNPDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN2O/c1-4(8)5-3-9-6(2-7)10-5/h3-4H,2,8H2,1H3.
What are the key properties of 1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine?
1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine has a molecular weight of 144.15 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine is sourced from PubChem (CID 84762832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).