4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine

C9H8FN3O — CID 135232669

IUPAC4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine
SMILESNc1nc(-c2ccc(CF)nc2)co1
InChIInChI=1S/C9H8FN3O/c10-3-7-2-1-6(4-12-7)8-5-14-9(11)13-8/h1-2,4-5H,3H2,(H2,11,13)
InChIKeySLVXNJLSOOVDSY-UHFFFAOYSA-N
MW193.18 g/mol
LogP1.79
Rot. Bonds2

About 4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine

4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine (PubChem CID 135232669) has the molecular formula C9H8FN3O and a molecular weight of 193.18 g/mol. Its IUPAC name is 4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine.

Molecular Properties

Compound Name4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine
PubChem CID135232669
Molecular FormulaC9H8FN3O
Molecular Weight193.18 g/mol
Exact Mass193.07
IUPAC Name4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine
SMILESNc1nc(-c2ccc(CF)nc2)co1
InChIInChI=1S/C9H8FN3O/c10-3-7-2-1-6(4-12-7)8-5-14-9(11)13-8/h1-2,4-5H,3H2,(H2,11,13)
InChIKeySLVXNJLSOOVDSY-UHFFFAOYSA-N
XLogP1.79
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.18
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine?
The IUPAC name of 4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine (CID 135232669) is 4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine.
What is the SMILES notation for 4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine?
The canonical SMILES for 4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine is Nc1nc(-c2ccc(CF)nc2)co1.
What is the InChIKey of 4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine?
The InChIKey is SLVXNJLSOOVDSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN3O/c10-3-7-2-1-6(4-12-7)8-5-14-9(11)13-8/h1-2,4-5H,3H2,(H2,11,13).
What are the key properties of 4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine?
4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine has a molecular weight of 193.18 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(fluoromethyl)-3-pyridinyl]-1,3-oxazol-2-amine is sourced from PubChem (CID 135232669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).