2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide

C5H6BrN3OS — CID 60785743

IUPAC2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide
SMILESNCC(=O)Nc1ncc(Br)s1
InChIInChI=1S/C5H6BrN3OS/c6-3-2-8-5(11-3)9-4(10)1-7/h2H,1,7H2,(H,8,9,10)
InChIKeyGSTGDWIJTFONDF-UHFFFAOYSA-N
MW236.09 g/mol
LogP0.80
Rot. Bonds2

About 2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide

2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide (PubChem CID 60785743) has the molecular formula C5H6BrN3OS and a molecular weight of 236.09 g/mol. Its IUPAC name is 2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide
PubChem CID60785743
Molecular FormulaC5H6BrN3OS
Molecular Weight236.09 g/mol
Exact Mass234.94
IUPAC Name2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide
SMILESNCC(=O)Nc1ncc(Br)s1
InChIInChI=1S/C5H6BrN3OS/c6-3-2-8-5(11-3)9-4(10)1-7/h2H,1,7H2,(H,8,9,10)
InChIKeyGSTGDWIJTFONDF-UHFFFAOYSA-N
XLogP0.80
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.09
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-bromo-1,3-thiazol-2-yl)propanamide
CID 60654828
7-amino-N-(5-bromo-1,3-thiazol-2-yl)heptanamide
CID 60783690
N-(5-bromo-1,3-thiazol-2-yl)butanamide
CID 22170788
2-(4-bromophenoxy)-N-(5-bromo-1,3-thiazol-2-yl)acetamide
CID 35524705
N-(5-bromo-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 79260824
2-(aminomethyl)-N-(5-bromo-1,3-thiazol-2-yl)-3-methylbutanamide
CID 65229801
1-[2-[(5-bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 54919633
N-(5-bromo-1,3-thiazol-2-yl)-2-(4-methoxyphenyl)acetamide
CID 22170781
N-(5-bromo-1,3-thiazol-2-yl)-2-(1-methoxycyclobutyl)acetamide
CID 103556726
N-(5-bromo-1,3-thiazol-2-yl)but-2-enamide
CID 76880215
methyl 2-[(5-bromo-1,3-thiazol-2-yl)amino]-2-oxoacetate
CID 53352081
4-amino-N-(5-bromo-1,3-thiazol-2-yl)cyclohexane-1-carboxamide
CID 60849806

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide (CID 60785743) is 2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide is NCC(=O)Nc1ncc(Br)s1.
What is the InChIKey of 2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide?
The InChIKey is GSTGDWIJTFONDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6BrN3OS/c6-3-2-8-5(11-3)9-4(10)1-7/h2H,1,7H2,(H,8,9,10).
What are the key properties of 2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide?
2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide has a molecular weight of 236.09 g/mol, XLogP of 0.80, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 60785743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).