5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine

C11H10F2N2S — CID 116811974

IUPAC5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine
SMILESCCNc1ncc(-c2ccc(F)cc2F)s1
InChIInChI=1S/C11H10F2N2S/c1-2-14-11-15-6-10(16-11)8-4-3-7(12)5-9(8)13/h3-6H,2H2,1H3,(H,14,15)
InChIKeyUYMBDQIWVPBLEP-UHFFFAOYSA-N
MW240.28 g/mol
LogP3.52
Rot. Bonds3

About 5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine

5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine (PubChem CID 116811974) has the molecular formula C11H10F2N2S and a molecular weight of 240.28 g/mol. Its IUPAC name is 5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine
PubChem CID116811974
Molecular FormulaC11H10F2N2S
Molecular Weight240.28 g/mol
Exact Mass240.05
IUPAC Name5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine
SMILESCCNc1ncc(-c2ccc(F)cc2F)s1
InChIInChI=1S/C11H10F2N2S/c1-2-14-11-15-6-10(16-11)8-4-3-7(12)5-9(8)13/h3-6H,2H2,1H3,(H,14,15)
InChIKeyUYMBDQIWVPBLEP-UHFFFAOYSA-N
XLogP3.52
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.28
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 60642208
5-(2,5-dimethylphenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116812054
5-(2-chlorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116811958
5-(2-bromophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116812031
N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine
CID 116811999
5-(5-bromo-2-fluorophenyl)-N-propyl-1,3-thiazol-2-amine
CID 116812191
5-(5-chloroquinolin-8-yl)-N-ethyl-1,3-thiazol-2-amine
CID 116811986
5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116812059
N-ethyl-5-[(3-fluorophenoxy)methyl]-1,3-thiazol-2-amine
CID 79774764
5-(2,4-dichlorophenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 116812335
N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine
CID 114558342
2-(2,4-difluorophenyl)-5-fluoropyridine
CID 130334925

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine (CID 116811974) is 5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine is CCNc1ncc(-c2ccc(F)cc2F)s1.
What is the InChIKey of 5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine?
The InChIKey is UYMBDQIWVPBLEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F2N2S/c1-2-14-11-15-6-10(16-11)8-4-3-7(12)5-9(8)13/h3-6H,2H2,1H3,(H,14,15).
What are the key properties of 5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine?
5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine has a molecular weight of 240.28 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 116811974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).