1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine

C9H15FN2O — CID 84770090

IUPAC1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine
SMILESCNC(C)Cc1nc(C)c(CF)o1
InChIInChI=1S/C9H15FN2O/c1-6(11-3)4-9-12-7(2)8(5-10)13-9/h6,11H,4-5H2,1-3H3
InChIKeyFUAIGFNLWUFMKE-UHFFFAOYSA-N
MW186.23 g/mol
LogP1.60
Rot. Bonds4

About 1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine

1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine (PubChem CID 84770090) has the molecular formula C9H15FN2O and a molecular weight of 186.23 g/mol. Its IUPAC name is 1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine
PubChem CID84770090
Molecular FormulaC9H15FN2O
Molecular Weight186.23 g/mol
Exact Mass186.12
IUPAC Name1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine
SMILESCNC(C)Cc1nc(C)c(CF)o1
InChIInChI=1S/C9H15FN2O/c1-6(11-3)4-9-12-7(2)8(5-10)13-9/h6,11H,4-5H2,1-3H3
InChIKeyFUAIGFNLWUFMKE-UHFFFAOYSA-N
XLogP1.60
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.23
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine?
The IUPAC name of 1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine (CID 84770090) is 1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine.
What is the SMILES notation for 1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine?
The canonical SMILES for 1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine is CNC(C)Cc1nc(C)c(CF)o1.
What is the InChIKey of 1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine?
The InChIKey is FUAIGFNLWUFMKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15FN2O/c1-6(11-3)4-9-12-7(2)8(5-10)13-9/h6,11H,4-5H2,1-3H3.
What are the key properties of 1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine?
1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine has a molecular weight of 186.23 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(fluoromethyl)-4-methyl-1,3-oxazol-2-yl]-N-methylpropan-2-amine is sourced from PubChem (CID 84770090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).