5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine

C10H9FN2S — CID 3387135

IUPAC5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine
SMILESNc1ncc(Cc2ccccc2F)s1
InChIInChI=1S/C10H9FN2S/c11-9-4-2-1-3-7(9)5-8-6-13-10(12)14-8/h1-4,6H,5H2,(H2,12,13)
InChIKeyMJWGGQHOCHEUHY-UHFFFAOYSA-N
MW208.26 g/mol
LogP2.46
Rot. Bonds2

About 5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine

5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine (PubChem CID 3387135) has the molecular formula C10H9FN2S and a molecular weight of 208.26 g/mol. Its IUPAC name is 5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine
PubChem CID3387135
Molecular FormulaC10H9FN2S
Molecular Weight208.26 g/mol
Exact Mass208.05
IUPAC Name5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine
SMILESNc1ncc(Cc2ccccc2F)s1
InChIInChI=1S/C10H9FN2S/c11-9-4-2-1-3-7(9)5-8-6-13-10(12)14-8/h1-4,6H,5H2,(H2,12,13)
InChIKeyMJWGGQHOCHEUHY-UHFFFAOYSA-N
XLogP2.46
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of 5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine (CID 3387135) is 5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine is Nc1ncc(Cc2ccccc2F)s1.
What is the InChIKey of 5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine?
The InChIKey is MJWGGQHOCHEUHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2S/c11-9-4-2-1-3-7(9)5-8-6-13-10(12)14-8/h1-4,6H,5H2,(H2,12,13).
What are the key properties of 5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine?
5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine has a molecular weight of 208.26 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 3387135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).