N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide

C8H11FN2OS — CID 130841255

IUPACN-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide
SMILESCCCC(=O)Nc1nc(C)c(F)s1
InChIInChI=1S/C8H11FN2OS/c1-3-4-6(12)11-8-10-5(2)7(9)13-8/h3-4H2,1-2H3,(H,10,11,12)
InChIKeyYCQQPWPNCQANHK-UHFFFAOYSA-N
MW202.25 g/mol
LogP2.33
Rot. Bonds3

About N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide

N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide (PubChem CID 130841255) has the molecular formula C8H11FN2OS and a molecular weight of 202.25 g/mol. Its IUPAC name is N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide.

Molecular Properties

Compound NameN-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide
PubChem CID130841255
Molecular FormulaC8H11FN2OS
Molecular Weight202.25 g/mol
Exact Mass202.06
IUPAC NameN-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide
SMILESCCCC(=O)Nc1nc(C)c(F)s1
InChIInChI=1S/C8H11FN2OS/c1-3-4-6(12)11-8-10-5(2)7(9)13-8/h3-4H2,1-2H3,(H,10,11,12)
InChIKeyYCQQPWPNCQANHK-UHFFFAOYSA-N
XLogP2.33
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4,5-dimethyl-1,3-thiazol-2-yl)pentanamide
CID 5181179
N-(5-chloro-4-methyl-1,3-thiazol-2-yl)pentanamide
CID 154106972
N-(4-fluoro-1,3-benzothiazol-2-yl)butanamide
CID 7193256
tert-butyl N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)carbamate
CID 45117835
N-[5-[(4-methoxyphenyl)methyl]-4-methyl-1,3-thiazol-2-yl]butanamide
CID 43836410
methyl 4-methyl-2-(pentanoylamino)-1,3-thiazole-5-carboxylate
CID 5058750
2-(hexanoylamino)-4-methyl-1,3-thiazole-5-carboxamide
CID 58719647
3-amino-N-(4-methyl-5-methylsulfanyl-1,3-thiazol-2-yl)propanamide
CID 130831835
3-[butyl(methyl)amino]-N-(4,5-dimethyl-1,3-thiazol-2-yl)propanamide
CID 108795401
3-[4-methyl-2-(pentanoylamino)-1,3-thiazol-5-yl]propanoic acid
CID 82058784
N-(4,5-dimethyl-1,3-thiazol-2-yl)-4-hydroxybutanamide
CID 79193438
2-(butanoylamino)-4-(4-fluorophenyl)-1,3-thiazole-5-carboxylic acid
CID 94970416

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide?
The IUPAC name of N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide (CID 130841255) is N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide.
What is the SMILES notation for N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide?
The canonical SMILES for N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide is CCCC(=O)Nc1nc(C)c(F)s1.
What is the InChIKey of N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide?
The InChIKey is YCQQPWPNCQANHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2OS/c1-3-4-6(12)11-8-10-5(2)7(9)13-8/h3-4H2,1-2H3,(H,10,11,12).
What are the key properties of N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide?
N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide has a molecular weight of 202.25 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-4-methyl-1,3-thiazol-2-yl)butanamide is sourced from PubChem (CID 130841255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).