4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine

C11H10ClFN2S — CID 83157193

IUPAC4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine
SMILESCCN(c1nc(Cl)cs1)c1ccccc1F
InChIInChI=1S/C11H10ClFN2S/c1-2-15(11-14-10(12)7-16-11)9-6-4-3-5-8(9)13/h3-7H,2H2,1H3
InChIKeyLQACXENWRBPSIU-UHFFFAOYSA-N
MW256.73 g/mol
LogP4.09
Rot. Bonds3

About 4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine

4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine (PubChem CID 83157193) has the molecular formula C11H10ClFN2S and a molecular weight of 256.73 g/mol. Its IUPAC name is 4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine
PubChem CID83157193
Molecular FormulaC11H10ClFN2S
Molecular Weight256.73 g/mol
Exact Mass256.02
IUPAC Name4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine
SMILESCCN(c1nc(Cl)cs1)c1ccccc1F
InChIInChI=1S/C11H10ClFN2S/c1-2-15(11-14-10(12)7-16-11)9-6-4-3-5-8(9)13/h3-7H,2H2,1H3
InChIKeyLQACXENWRBPSIU-UHFFFAOYSA-N
XLogP4.09
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.73
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(2-fluorophenyl)-N-methyl-1,3-thiazol-2-amine
CID 83156953
4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine
CID 83157073
4-chloro-N-[1-(2-fluorophenyl)ethyl]-N-methyl-1,3-thiazol-2-amine
CID 83157199
N-ethyl-5-(ethylaminomethyl)-N-(2-fluorophenyl)-4-methyl-1,3-thiazol-2-amine
CID 62768210
6-chloro-4-N-ethyl-4-N-(2-fluorophenyl)pyrimidine-4,5-diamine
CID 63023431
N,4-diethyl-N-(2-fluorophenyl)-5-(methylaminomethyl)-1,3-thiazol-2-amine
CID 62768385
3-chloro-1-N-ethyl-1-N-(2-fluorophenyl)benzene-1,2-diamine
CID 104834416
4-chloro-6-ethoxy-N-ethyl-N-(2-fluorophenyl)-1,3,5-triazin-2-amine
CID 62858407
6-chloro-N-ethyl-N-(2-fluorophenyl)-5-propylpyrimidin-4-amine
CID 63728499
4-chloro-N,N-dimethyl-1,3-thiazol-2-amine
CID 68840678
3-N-ethyl-3-N-(2-fluorophenyl)quinoxaline-2,3-diamine
CID 102985770
2-chloro-4-(chloromethyl)-N-ethyl-N-(2-fluorophenyl)aniline
CID 81151857

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine (CID 83157193) is 4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine is CCN(c1nc(Cl)cs1)c1ccccc1F.
What is the InChIKey of 4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine?
The InChIKey is LQACXENWRBPSIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClFN2S/c1-2-15(11-14-10(12)7-16-11)9-6-4-3-5-8(9)13/h3-7H,2H2,1H3.
What are the key properties of 4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine?
4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine has a molecular weight of 256.73 g/mol, XLogP of 4.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 83157193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).