5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine

C6H9FN2S — CID 90064527

IUPAC5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine
SMILESCC(C)Nc1ncc(F)s1
InChIInChI=1S/C6H9FN2S/c1-4(2)9-6-8-3-5(7)10-6/h3-4H,1-2H3,(H,8,9)
InChIKeyUZAVRSYBXNVJEL-UHFFFAOYSA-N
MW160.22 g/mol
LogP2.10
Rot. Bonds2

About 5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine

5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine (PubChem CID 90064527) has the molecular formula C6H9FN2S and a molecular weight of 160.22 g/mol. Its IUPAC name is 5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine
PubChem CID90064527
Molecular FormulaC6H9FN2S
Molecular Weight160.22 g/mol
Exact Mass160.05
IUPAC Name5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine
SMILESCC(C)Nc1ncc(F)s1
InChIInChI=1S/C6H9FN2S/c1-4(2)9-6-8-3-5(7)10-6/h3-4H,1-2H3,(H,8,9)
InChIKeyUZAVRSYBXNVJEL-UHFFFAOYSA-N
XLogP2.10
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine (CID 90064527) is 5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine is CC(C)Nc1ncc(F)s1.
What is the InChIKey of 5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine?
The InChIKey is UZAVRSYBXNVJEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN2S/c1-4(2)9-6-8-3-5(7)10-6/h3-4H,1-2H3,(H,8,9).
What are the key properties of 5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine?
5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine has a molecular weight of 160.22 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-propan-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 90064527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).