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

C6H9FN2O — CID 84762823

IUPAC1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine
SMILESCNCc1ncc(CF)o1
InChIInChI=1S/C6H9FN2O/c1-8-4-6-9-3-5(2-7)10-6/h3,8H,2,4H2,1H3
InChIKeyIEHNLVVHIVUKFF-UHFFFAOYSA-N
MW144.15 g/mol
LogP0.86
Rot. Bonds3

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

1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine (PubChem CID 84762823) has the molecular formula C6H9FN2O and a molecular weight of 144.15 g/mol. Its IUPAC name is 1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine
PubChem CID84762823
Molecular FormulaC6H9FN2O
Molecular Weight144.15 g/mol
Exact Mass144.07
IUPAC Name1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine
SMILESCNCc1ncc(CF)o1
InChIInChI=1S/C6H9FN2O/c1-8-4-6-9-3-5(2-7)10-6/h3,8H,2,4H2,1H3
InChIKeyIEHNLVVHIVUKFF-UHFFFAOYSA-N
XLogP0.86
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.15
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine (CID 84762823) is 1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine is CNCc1ncc(CF)o1.
What is the InChIKey of 1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine?
The InChIKey is IEHNLVVHIVUKFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN2O/c1-8-4-6-9-3-5(2-7)10-6/h3,8H,2,4H2,1H3.
What are the key properties of 1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine?
1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine has a molecular weight of 144.15 g/mol, XLogP of 0.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(fluoromethyl)-1,3-oxazol-2-yl]-N-methylmethanamine is sourced from PubChem (CID 84762823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).