5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine

C11H10F2N2S — CID 83853866

IUPAC5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine
SMILESCC(F)(F)c1sc(N)nc1-c1ccccc1
InChIInChI=1S/C11H10F2N2S/c1-11(12,13)9-8(15-10(14)16-9)7-5-3-2-4-6-7/h2-6H,1H3,(H2,14,15)
InChIKeyHGOYLMLGRHNDTC-UHFFFAOYSA-N
MW240.28 g/mol
LogP3.50
Rot. Bonds2

About 5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine

5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine (PubChem CID 83853866) has the molecular formula C11H10F2N2S and a molecular weight of 240.28 g/mol. Its IUPAC name is 5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine
PubChem CID83853866
Molecular FormulaC11H10F2N2S
Molecular Weight240.28 g/mol
Exact Mass240.05
IUPAC Name5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine
SMILESCC(F)(F)c1sc(N)nc1-c1ccccc1
InChIInChI=1S/C11H10F2N2S/c1-11(12,13)9-8(15-10(14)16-9)7-5-3-2-4-6-7/h2-6H,1H3,(H2,14,15)
InChIKeyHGOYLMLGRHNDTC-UHFFFAOYSA-N
XLogP3.50
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.28
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-phenyl-1,3-thiazol-2-amine
CID 123206228
5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride
CID 84783642
4-(4-phenylphenyl)-1,3-thiazole-2,5-diamine
CID 82342174
4-phenyl-5-(1,1,2,2-tetrafluoroethoxy)-1,3-thiazol-2-amine
CID 57381908
4-phenyl-5-(2-phenylethyl)-1,3-thiazol-2-amine
CID 88924616
5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine
CID 26597941
4-(4-methoxyphenyl)-5-(4-phenylphenyl)-1,3-thiazol-2-amine
CID 88568617
5-benzyl-4-phenyl-1,3-thiazol-2-amine
CID 57476891
2-amino-N-methyl-N,4-diphenyl-1,3-thiazole-5-carboxamide
CID 39071360
5-pentyl-4-phenyl-1,3-thiazol-2-amine
CID 3356434
4-(4-chlorophenyl)-5-phenyl-1,3-thiazol-2-amine
CID 2806452
5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine
CID 135672336

Frequently Asked Questions

What is the IUPAC name of 5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine (CID 83853866) is 5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine is CC(F)(F)c1sc(N)nc1-c1ccccc1.
What is the InChIKey of 5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine?
The InChIKey is HGOYLMLGRHNDTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F2N2S/c1-11(12,13)9-8(15-10(14)16-9)7-5-3-2-4-6-7/h2-6H,1H3,(H2,14,15).
What are the key properties of 5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine?
5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine has a molecular weight of 240.28 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 83853866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).