2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide

C10H17N3OS — CID 82547698

IUPAC2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide
SMILESNCCCCCc1nc(CC(N)=O)cs1
InChIInChI=1S/C10H17N3OS/c11-5-3-1-2-4-10-13-8(7-15-10)6-9(12)14/h7H,1-6,11H2,(H2,12,14)
InChIKeyYGJBKQXLUZHYAG-UHFFFAOYSA-N
MW227.33 g/mol
LogP0.84
Rot. Bonds7

About 2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide

2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide (PubChem CID 82547698) has the molecular formula C10H17N3OS and a molecular weight of 227.33 g/mol. Its IUPAC name is 2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide.

Molecular Properties

Compound Name2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide
PubChem CID82547698
Molecular FormulaC10H17N3OS
Molecular Weight227.33 g/mol
Exact Mass227.11
IUPAC Name2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide
SMILESNCCCCCc1nc(CC(N)=O)cs1
InChIInChI=1S/C10H17N3OS/c11-5-3-1-2-4-10-13-8(7-15-10)6-9(12)14/h7H,1-6,11H2,(H2,12,14)
InChIKeyYGJBKQXLUZHYAG-UHFFFAOYSA-N
XLogP0.84
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

ethyl 2-[2-(4-aminobutyl)-1,3-thiazol-4-yl]acetate
CID 107380238
2-(2-propyl-1,3-thiazol-4-yl)acetamide
CID 89272133
ethane;2-(2-propyl-1,3-thiazol-4-yl)acetamide
CID 143669035
ethyl 2-[2-(3-aminopropyl)-1,3-thiazol-4-yl]acetate
CID 107380154
2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]-N-(4-methylpiperazin-1-yl)acetamide
CID 110450519
2-[2-(3-aminopropyl)-1,3-thiazol-4-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 82547668
4-[[2-[2-(3-aminopropyl)-1,3-thiazol-4-yl]acetyl]amino]butanoic acid
CID 82547800
2-[2-(3-aminopropyl)-1,3-thiazol-4-yl]-N-(4-hydroxyphenyl)acetamide
CID 82547722
2-(4-ethyl-1,3-thiazol-2-yl)acetamide
CID 116970126
2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide
CID 82547702
2-[2-(3-aminopropyl)-1,3-thiazol-4-yl]-N-(4-hydroxycyclohexyl)acetamide
CID 82547664
3-[4-(2-aminoethyl)-1,3-thiazol-2-yl]propan-1-ol
CID 115087624

Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide?
The IUPAC name of 2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide (CID 82547698) is 2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide.
What is the SMILES notation for 2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide?
The canonical SMILES for 2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide is NCCCCCc1nc(CC(N)=O)cs1.
What is the InChIKey of 2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide?
The InChIKey is YGJBKQXLUZHYAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS/c11-5-3-1-2-4-10-13-8(7-15-10)6-9(12)14/h7H,1-6,11H2,(H2,12,14).
What are the key properties of 2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide?
2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide has a molecular weight of 227.33 g/mol, XLogP of 0.84, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide is sourced from PubChem (CID 82547698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).