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

C16H13FN2OS — CID 4093037

IUPAC4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccc(Nc2nc(-c3ccc(F)cc3)cs2)cc1
InChIInChI=1S/C16H13FN2OS/c1-20-14-8-6-13(7-9-14)18-16-19-15(10-21-16)11-2-4-12(17)5-3-11/h2-10H,1H3,(H,18,19)
InChIKeyZJZCGGNUYGEJAZ-UHFFFAOYSA-N
MW300.36 g/mol
LogP4.70
Rot. Bonds4

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

4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine (PubChem CID 4093037) has the molecular formula C16H13FN2OS and a molecular weight of 300.36 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
PubChem CID4093037
Molecular FormulaC16H13FN2OS
Molecular Weight300.36 g/mol
Exact Mass300.07
IUPAC Name4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccc(Nc2nc(-c3ccc(F)cc3)cs2)cc1
InChIInChI=1S/C16H13FN2OS/c1-20-14-8-6-13(7-9-14)18-16-19-15(10-21-16)11-2-4-12(17)5-3-11/h2-10H,1H3,(H,18,19)
InChIKeyZJZCGGNUYGEJAZ-UHFFFAOYSA-N
XLogP4.70
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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
4-(4-fluorophenyl)-N-(4-phenoxyphenyl)-1,3-thiazol-2-amine;hydrobromide
CID 2858168
4-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-amine
CID 124927933
N-[4-[2-(4-fluoroanilino)-1,3-thiazol-4-yl]phenyl]-2,4-dimethoxybenzamide
CID 4997777
N-(4-methoxyphenyl)-4-(4-methylsulfonylphenyl)-1,3-thiazol-2-amine
CID 17398323
4-(3-chloro-4-methoxyphenyl)-N-(4-fluorophenyl)-1,3-thiazol-2-amine
CID 166194851
N-(4-fluorophenyl)-4-pyridin-4-yl-1,3-thiazol-2-amine;hydrochloride
CID 163328871
4-(3,4-dimethoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine;hydrobromide
CID 2877323
4-(5-fluoro-2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 8962514
N-[4-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]phenyl]propanamide
CID 156772101
4-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-1,3-thiazol-2-amine
CID 12790440

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine (CID 4093037) is 4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine is COc1ccc(Nc2nc(-c3ccc(F)cc3)cs2)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine?
The InChIKey is ZJZCGGNUYGEJAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2OS/c1-20-14-8-6-13(7-9-14)18-16-19-15(10-21-16)11-2-4-12(17)5-3-11/h2-10H,1H3,(H,18,19).
What are the key properties of 4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine?
4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine has a molecular weight of 300.36 g/mol, XLogP of 4.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 4093037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).