4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine

C13H15FN2OS — CID 8962681

IUPAC4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine
SMILESCCCNc1nc(-c2cc(F)ccc2OC)cs1
InChIInChI=1S/C13H15FN2OS/c1-3-6-15-13-16-11(8-18-13)10-7-9(14)4-5-12(10)17-2/h4-5,7-8H,3,6H2,1-2H3,(H,15,16)
InChIKeyKIPDKOUHQNCELU-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.78
Rot. Bonds5

About 4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine

4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine (PubChem CID 8962681) has the molecular formula C13H15FN2OS and a molecular weight of 266.34 g/mol. Its IUPAC name is 4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine
PubChem CID8962681
Molecular FormulaC13H15FN2OS
Molecular Weight266.34 g/mol
Exact Mass266.09
IUPAC Name4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine
SMILESCCCNc1nc(-c2cc(F)ccc2OC)cs1
InChIInChI=1S/C13H15FN2OS/c1-3-6-15-13-16-11(8-18-13)10-7-9(14)4-5-12(10)17-2/h4-5,7-8H,3,6H2,1-2H3,(H,15,16)
InChIKeyKIPDKOUHQNCELU-UHFFFAOYSA-N
XLogP3.78
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-difluorophenyl)-4-(5-fluoro-2-methoxyphenyl)-1,3-thiazol-2-amine
CID 166379526
4-(5-fluoro-2-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 8962514
4-(5-fluoro-2-methoxyphenyl)-N-[(2S)-1-methoxypropan-2-yl]-1,3-thiazol-2-amine
CID 8878537
4-(2,5-dimethoxyphenyl)-N-ethyl-1,3-thiazol-2-amine
CID 8962407
2-ethyl-6-(5-fluoro-2-methoxyphenyl)-N-propylpyrimidin-4-amine
CID 80939031
[4-(5-fluoro-2-methoxyphenyl)-1,3-thiazol-2-yl]methanethiol
CID 116965875
3-bromo-5-fluoro-N-[4-(5-fluoro-2-methoxyphenyl)-1,3-thiazol-2-yl]benzamide
CID 55722696
4-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 60642208
4-(4-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine
CID 8962689
2-(2,4-dimethoxyphenyl)-N-[4-(5-fluoro-2-methoxyphenyl)-1,3-thiazol-2-yl]acetamide
CID 55723018
N-[1-[[4-(5-fluoro-2-methoxyphenyl)-1,3-thiazol-2-yl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide
CID 86991640
N-[4-(5-fluoro-2-methoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-phenylacetyl)amino]propanamide
CID 55722948

Frequently Asked Questions

What is the IUPAC name of 4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine?
The IUPAC name of 4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine (CID 8962681) is 4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine is CCCNc1nc(-c2cc(F)ccc2OC)cs1.
What is the InChIKey of 4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine?
The InChIKey is KIPDKOUHQNCELU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN2OS/c1-3-6-15-13-16-11(8-18-13)10-7-9(14)4-5-12(10)17-2/h4-5,7-8H,3,6H2,1-2H3,(H,15,16).
What are the key properties of 4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine?
4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine has a molecular weight of 266.34 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-fluoro-2-methoxyphenyl)-N-propyl-1,3-thiazol-2-amine is sourced from PubChem (CID 8962681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).