5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride

C4H6ClFN2S — CID 71757840

IUPAC5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride
SMILESCc1nc(N)sc1F.Cl
InChIInChI=1S/C4H5FN2S.ClH/c1-2-3(5)8-4(6)7-2;/h1H3,(H2,6,7);1H
InChIKeyDGBSIDBGEVRJDH-UHFFFAOYSA-N
MW168.62 g/mol
LogP1.59
Rot. Bonds

About 5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride

5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride (PubChem CID 71757840) has the molecular formula C4H6ClFN2S and a molecular weight of 168.62 g/mol. Its IUPAC name is 5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride.

Molecular Properties

Compound Name5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride
PubChem CID71757840
Molecular FormulaC4H6ClFN2S
Molecular Weight168.62 g/mol
Exact Mass167.99
IUPAC Name5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride
SMILESCc1nc(N)sc1F.Cl
InChIInChI=1S/C4H5FN2S.ClH/c1-2-3(5)8-4(6)7-2;/h1H3,(H2,6,7);1H
InChIKeyDGBSIDBGEVRJDH-UHFFFAOYSA-N
XLogP1.59
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.62
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride?
The IUPAC name of 5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride (CID 71757840) is 5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride.
What is the SMILES notation for 5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride?
The canonical SMILES for 5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride is Cc1nc(N)sc1F.Cl.
What is the InChIKey of 5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride?
The InChIKey is DGBSIDBGEVRJDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5FN2S.ClH/c1-2-3(5)8-4(6)7-2;/h1H3,(H2,6,7);1H.
What are the key properties of 5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride?
5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride has a molecular weight of 168.62 g/mol, XLogP of 1.59, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride is sourced from PubChem (CID 71757840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).