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

C11H11FN2S — CID 1132723

IUPACN-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine
SMILESCCNc1nc(-c2ccc(F)cc2)cs1
InChIInChI=1S/C11H11FN2S/c1-2-13-11-14-10(7-15-11)8-3-5-9(12)6-4-8/h3-7H,2H2,1H3,(H,13,14)
InChIKeyMLLHCHQXUJICLI-UHFFFAOYSA-N
MW222.29 g/mol
LogP3.38
Rot. Bonds3

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

N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine (PubChem CID 1132723) has the molecular formula C11H11FN2S and a molecular weight of 222.29 g/mol. Its IUPAC name is N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine
PubChem CID1132723
Molecular FormulaC11H11FN2S
Molecular Weight222.29 g/mol
Exact Mass222.06
IUPAC NameN-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine
SMILESCCNc1nc(-c2ccc(F)cc2)cs1
InChIInChI=1S/C11H11FN2S/c1-2-13-11-14-10(7-15-11)8-3-5-9(12)6-4-8/h3-7H,2H2,1H3,(H,13,14)
InChIKeyMLLHCHQXUJICLI-UHFFFAOYSA-N
XLogP3.38
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-amine
CID 55027194
N-(cyclopropylmethyl)-4-(4-fluorophenyl)-1,3-thiazol-2-amine
CID 133371002
N-[(3,5-dimethylpyrazolidin-4-yl)methyl]-4-(4-fluorophenyl)-1,3-thiazol-2-amine
CID 133371930
4-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 60642208
3-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]-2,2-dimethylpropanamide
CID 133371380
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]butanamide
CID 704241
4-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-2-amine
CID 12790440
N,4-bis(4-fluorophenyl)-1,3-thiazol-2-amine;hydrobromide
CID 2840600
N-(4-fluorophenyl)-4-(4-methylphenyl)-1,3-thiazol-2-amine;hydrobromide
CID 2840281
3-chloro-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,2-dimethylpropanamide
CID 63679014
N-[4-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]phenyl]propanamide
CID 156772101
4-(4-fluorophenyl)-N-[2-(triazol-1-yl)ethyl]-1,3-thiazol-2-amine
CID 133449438

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine?
The IUPAC name of N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine (CID 1132723) is N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine is CCNc1nc(-c2ccc(F)cc2)cs1.
What is the InChIKey of N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine?
The InChIKey is MLLHCHQXUJICLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2S/c1-2-13-11-14-10(7-15-11)8-3-5-9(12)6-4-8/h3-7H,2H2,1H3,(H,13,14).
What are the key properties of N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine?
N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine has a molecular weight of 222.29 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 1132723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).