(3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone

C8H10FN3OS — CID 130694050

IUPAC(3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone
SMILESCNc1ncc(C(=O)N2CC(F)C2)s1
InChIInChI=1S/C8H10FN3OS/c1-10-8-11-2-6(14-8)7(13)12-3-5(9)4-12/h2,5H,3-4H2,1H3,(H,10,11)
InChIKeyKWCKHTHTFPETQZ-UHFFFAOYSA-N
MW215.25 g/mol
LogP0.98
Rot. Bonds2

About (3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone

(3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone (PubChem CID 130694050) has the molecular formula C8H10FN3OS and a molecular weight of 215.25 g/mol. Its IUPAC name is (3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone.

Molecular Properties

Compound Name(3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone
PubChem CID130694050
Molecular FormulaC8H10FN3OS
Molecular Weight215.25 g/mol
Exact Mass215.05
IUPAC Name(3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone
SMILESCNc1ncc(C(=O)N2CC(F)C2)s1
InChIInChI=1S/C8H10FN3OS/c1-10-8-11-2-6(14-8)7(13)12-3-5(9)4-12/h2,5H,3-4H2,1H3,(H,10,11)
InChIKeyKWCKHTHTFPETQZ-UHFFFAOYSA-N
XLogP0.98
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(Methylamino)thiazole-5-carboxamide
CID 56609316
2-amino-N-methyl-1,3-thiazole-5-carboxamide
CID 59600355
N-[2-(cyclopropylmethylsulfanyl)ethyl]-2-(ethylamino)-1,3-thiazole-5-carboxamide
CID 75496100
2-(ethylamino)-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide
CID 84590724
[2-(Ethylamino)-1,3-thiazol-5-yl]-(1,2-oxazolidin-2-yl)methanone
CID 86797132
2-(ethylamino)-N-[(3S)-5-oxo-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]-1,3-thiazole-5-carboxamide
CID 96525682
[2-(Ethylamino)-1,3-thiazol-5-yl]-piperidin-1-ylmethanone
CID 97236851
(2-amino-1,3-thiazol-5-yl)-[(3S)-3-methyl-4-propan-2-ylpiperazin-1-yl]methanone
CID 125525751
2-(3-methyl-2-oxoimidazolidin-1-yl)-N-(3,3,3-trifluoropropyl)-1,3-thiazole-5-carboxamide
CID 132469550
N-[5-fluoro-1-(2-fluoroethyl)-6-oxo-3-pyridinyl]-2-(methylamino)-1,3-thiazole-5-carboxamide
CID 167673559
2-[4-(3-fluoropyrrolidin-1-yl)piperidin-1-yl]-N-methyl-1,3-thiazole-5-carboxamide
CID 169149034
2-Acetamidothiazole-5-carboxamide
CID 119098439

Frequently Asked Questions

What is the IUPAC name of (3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone?
The IUPAC name of (3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone (CID 130694050) is (3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone.
What is the SMILES notation for (3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone?
The canonical SMILES for (3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone is CNc1ncc(C(=O)N2CC(F)C2)s1.
What is the InChIKey of (3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone?
The InChIKey is KWCKHTHTFPETQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN3OS/c1-10-8-11-2-6(14-8)7(13)12-3-5(9)4-12/h2,5H,3-4H2,1H3,(H,10,11).
What are the key properties of (3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone?
(3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone has a molecular weight of 215.25 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoroazetidin-1-yl)-[2-(methylamino)-1,3-thiazol-5-yl]methanone is sourced from PubChem (CID 130694050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).