2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine

C12H18FN3S — CID 146489969

IUPAC2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine
SMILESCNC1=CSC(C2=CN(C)C(C)C(F)=C2)N1C
InChIInChI=1S/C12H18FN3S/c1-8-10(13)5-9(6-15(8)3)12-16(4)11(14-2)7-17-12/h5-8,12,14H,1-4H3
InChIKeyYGUKKKRPYOLJQR-UHFFFAOYSA-N
MW255.36 g/mol
LogP2.08
Rot. Bonds2

About 2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine

2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine (PubChem CID 146489969) has the molecular formula C12H18FN3S and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine.

Molecular Properties

Compound Name2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine
PubChem CID146489969
Molecular FormulaC12H18FN3S
Molecular Weight255.36 g/mol
Exact Mass255.12
IUPAC Name2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine
SMILESCNC1=CSC(C2=CN(C)C(C)C(F)=C2)N1C
InChIInChI=1S/C12H18FN3S/c1-8-10(13)5-9(6-15(8)3)12-16(4)11(14-2)7-17-12/h5-8,12,14H,1-4H3
InChIKeyYGUKKKRPYOLJQR-UHFFFAOYSA-N
XLogP2.08
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine?
The IUPAC name of 2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine (CID 146489969) is 2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine.
What is the SMILES notation for 2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine?
The canonical SMILES for 2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine is CNC1=CSC(C2=CN(C)C(C)C(F)=C2)N1C.
What is the InChIKey of 2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine?
The InChIKey is YGUKKKRPYOLJQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18FN3S/c1-8-10(13)5-9(6-15(8)3)12-16(4)11(14-2)7-17-12/h5-8,12,14H,1-4H3.
What are the key properties of 2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine?
2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine has a molecular weight of 255.36 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-1,2-dimethyl-2H-pyridin-5-yl)-N,3-dimethyl-2H-1,3-thiazol-4-amine is sourced from PubChem (CID 146489969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).