N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide

C15H16F2N2OS — CID 26207795

IUPACN-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide
SMILESCCCCCC(=O)Nc1nc(-c2cc(F)ccc2F)cs1
InChIInChI=1S/C15H16F2N2OS/c1-2-3-4-5-14(20)19-15-18-13(9-21-15)11-8-10(16)6-7-12(11)17/h6-9H,2-5H2,1H3,(H,18,19,20)
InChIKeySLDVOXWVVKDMIM-UHFFFAOYSA-N
MW310.37 g/mol
LogP4.61
Rot. Bonds6

About N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide

N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide (PubChem CID 26207795) has the molecular formula C15H16F2N2OS and a molecular weight of 310.37 g/mol. Its IUPAC name is N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide.

Molecular Properties

Compound NameN-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide
PubChem CID26207795
Molecular FormulaC15H16F2N2OS
Molecular Weight310.37 g/mol
Exact Mass310.10
IUPAC NameN-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide
SMILESCCCCCC(=O)Nc1nc(-c2cc(F)ccc2F)cs1
InChIInChI=1S/C15H16F2N2OS/c1-2-3-4-5-14(20)19-15-18-13(9-21-15)11-8-10(16)6-7-12(11)17/h6-9H,2-5H2,1H3,(H,18,19,20)
InChIKeySLDVOXWVVKDMIM-UHFFFAOYSA-N
XLogP4.61
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.37
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide
CID 18089737
N-[4-(2,5-dichlorophenyl)-1,3-thiazol-2-yl]pentanamide
CID 2372983
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]butanamide
CID 38910434
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(4-methoxyphenyl)acetamide
CID 8839170
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide
CID 30847400
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]decanamide
CID 4302943
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-methylphenoxy)acetamide
CID 8839185
4-bromo-N-[3-[[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]amino]-3-oxopropyl]benzamide
CID 26207672
N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]hexadecanamide
CID 4161318
2-(4-acetamidophenyl)sulfanyl-N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]acetamide
CID 34518213
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 43042841
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]butanamide
CID 704241

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide?
The IUPAC name of N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide (CID 26207795) is N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide.
What is the SMILES notation for N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide?
The canonical SMILES for N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide is CCCCCC(=O)Nc1nc(-c2cc(F)ccc2F)cs1.
What is the InChIKey of N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide?
The InChIKey is SLDVOXWVVKDMIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N2OS/c1-2-3-4-5-14(20)19-15-18-13(9-21-15)11-8-10(16)6-7-12(11)17/h6-9H,2-5H2,1H3,(H,18,19,20).
What are the key properties of N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide?
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide has a molecular weight of 310.37 g/mol, XLogP of 4.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide is sourced from PubChem (CID 26207795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).