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

C16H13FN2S — CID 157269328

IUPACN-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine
SMILESCc1cccc(-c2csc(Nc3ccccc3F)n2)c1
InChIInChI=1S/C16H13FN2S/c1-11-5-4-6-12(9-11)15-10-20-16(19-15)18-14-8-3-2-7-13(14)17/h2-10H,1H3,(H,18,19)
InChIKeyLMKQSNYIVWRLEL-UHFFFAOYSA-N
MW284.36 g/mol
LogP5.00
Rot. Bonds3

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

N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine (PubChem CID 157269328) has the molecular formula C16H13FN2S and a molecular weight of 284.36 g/mol. Its IUPAC name is N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine
PubChem CID157269328
Molecular FormulaC16H13FN2S
Molecular Weight284.36 g/mol
Exact Mass284.08
IUPAC NameN-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine
SMILESCc1cccc(-c2csc(Nc3ccccc3F)n2)c1
InChIInChI=1S/C16H13FN2S/c1-11-5-4-6-12(9-11)15-10-20-16(19-15)18-14-8-3-2-7-13(14)17/h2-10H,1H3,(H,18,19)
InChIKeyLMKQSNYIVWRLEL-UHFFFAOYSA-N
XLogP5.00
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.36
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(2-fluoroanilino)-1,3-thiazol-4-yl]benzonitrile
CID 153365704
N-(2-fluorophenyl)-4-[3-(1-methoxycyclopropyl)phenyl]-1,3-thiazol-2-amine
CID 153365689
N-(2-fluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazol-2-amine;N-(3-fluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazol-2-amine;N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine;N-(3-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine;2-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazole;N-(2-fluorophenyl)-4-phenyl-1,3-thiazol-2-amine
CID 158895777
4-[4-(aminomethyl)phenyl]-N-(2-fluorophenyl)-1,3-thiazol-2-amine;bis(4-(3-ethylphenyl)-N-(2-fluorophenyl)-1,3-thiazol-2-amine);4-[4-[2-(2-fluoroanilino)-1,3-thiazol-4-yl]phenyl]butan-2-one;bis(N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine)
CID 158343213
N-cyclopropyl-4-(3-methylphenyl)-1,3-thiazol-2-amine
CID 62941085
4-(3-methylphenyl)-N-propyl-1,3-thiazol-2-amine
CID 62943868
N-(2,4-dimethylphenyl)-4-naphthalen-2-yl-1,3-thiazol-2-amine
CID 2132345
O-methyl 5-methyl-4-[[4-(3-methylphenyl)-1,3-thiazol-2-yl]amino]thiophene-2-carbothioate
CID 86584791
(2S)-2-ethyl-N-[3-[2-(2-fluoroanilino)-1,3-thiazol-4-yl]phenyl]hexanamide
CID 7415959
N-(2-fluorophenyl)-4-(1-propylpyrazol-4-yl)-1,3-thiazol-2-amine
CID 25205061
ethane;2-methyl-4-(3-methylphenyl)-1,3-thiazole
CID 142374611
4-(2,4-dichloro-5-fluorophenyl)-N-(2-methylphenyl)-1,3-thiazol-2-amine
CID 10861139

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine?
The IUPAC name of N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine (CID 157269328) is N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine is Cc1cccc(-c2csc(Nc3ccccc3F)n2)c1.
What is the InChIKey of N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine?
The InChIKey is LMKQSNYIVWRLEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2S/c1-11-5-4-6-12(9-11)15-10-20-16(19-15)18-14-8-3-2-7-13(14)17/h2-10H,1H3,(H,18,19).
What are the key properties of N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine?
N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine has a molecular weight of 284.36 g/mol, XLogP of 5.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 157269328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).