N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide

C15H17FN2OS — CID 19210425

IUPACN-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide
SMILESCCCCC(=O)Nc1nc(-c2ccc(F)cc2)c(C)s1
InChIInChI=1S/C15H17FN2OS/c1-3-4-5-13(19)17-15-18-14(10(2)20-15)11-6-8-12(16)9-7-11/h6-9H,3-5H2,1-2H3,(H,17,18,19)
InChIKeyVVYAWNZJHPTNPD-UHFFFAOYSA-N
MW292.38 g/mol
LogP4.39
Rot. Bonds5

About N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide

N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide (PubChem CID 19210425) has the molecular formula C15H17FN2OS and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide.

Molecular Properties

Compound NameN-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide
PubChem CID19210425
Molecular FormulaC15H17FN2OS
Molecular Weight292.38 g/mol
Exact Mass292.10
IUPAC NameN-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide
SMILESCCCCC(=O)Nc1nc(-c2ccc(F)cc2)c(C)s1
InChIInChI=1S/C15H17FN2OS/c1-3-4-5-13(19)17-15-18-14(10(2)20-15)11-6-8-12(16)9-7-11/h6-9H,3-5H2,1-2H3,(H,17,18,19)
InChIKeyVVYAWNZJHPTNPD-UHFFFAOYSA-N
XLogP4.39
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]pentanamide
CID 19172938
7-amino-N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]heptanamide
CID 119681442
3-chloro-N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]propanamide
CID 19226381
4-[[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino]-4-oxobutanoic acid
CID 3431018
N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide
CID 3323337
2-amino-N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]acetamide
CID 39177617
4-(1,3-dioxoisoindol-2-yl)-N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]butanamide
CID 19219149
N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-4-(4-fluorophenyl)sulfanylbutanamide
CID 41271730
N-[4-(3,4-dimethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide
CID 48998332
2-cyano-N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]acetamide
CID 167954925
N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]-3-(1,2,4-triazol-1-yl)propanamide
CID 134036011
2-(butanoylamino)-4-(4-fluorophenyl)-1,3-thiazole-5-carboxylic acid
CID 94970416

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide?
The IUPAC name of N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide (CID 19210425) is N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide.
What is the SMILES notation for N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide?
The canonical SMILES for N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide is CCCCC(=O)Nc1nc(-c2ccc(F)cc2)c(C)s1.
What is the InChIKey of N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide?
The InChIKey is VVYAWNZJHPTNPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2OS/c1-3-4-5-13(19)17-15-18-14(10(2)20-15)11-6-8-12(16)9-7-11/h6-9H,3-5H2,1-2H3,(H,17,18,19).
What are the key properties of N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide?
N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide has a molecular weight of 292.38 g/mol, XLogP of 4.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]pentanamide is sourced from PubChem (CID 19210425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).