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

C7H11N3OS — CID 82547702

IUPAC2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide
SMILESCC(N)c1nc(CC(N)=O)cs1
InChIInChI=1S/C7H11N3OS/c1-4(8)7-10-5(3-12-7)2-6(9)11/h3-4H,2,8H2,1H3,(H2,9,11)
InChIKeyUGBJLURRPQNLMP-UHFFFAOYSA-N
MW185.25 g/mol
LogP0.19
Rot. Bonds3

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

2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide (PubChem CID 82547702) has the molecular formula C7H11N3OS and a molecular weight of 185.25 g/mol. Its IUPAC name is 2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide.

Molecular Properties

Compound Name2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide
PubChem CID82547702
Molecular FormulaC7H11N3OS
Molecular Weight185.25 g/mol
Exact Mass185.06
IUPAC Name2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide
SMILESCC(N)c1nc(CC(N)=O)cs1
InChIInChI=1S/C7H11N3OS/c1-4(8)7-10-5(3-12-7)2-6(9)11/h3-4H,2,8H2,1H3,(H2,9,11)
InChIKeyUGBJLURRPQNLMP-UHFFFAOYSA-N
XLogP0.19
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.25
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]-N-methylacetamide
CID 82547688
(1R)-1-(4-ethyl-1,3-thiazol-2-yl)ethanamine
CID 42077975
2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]-N-cyclopropylacetamide
CID 82548102
2-[[2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetyl]-methylamino]acetic acid
CID 82547915
2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]-1-morpholin-4-ylethanone
CID 82547942
2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]-1-piperazin-1-ylethanone
CID 82511924
ethyl 2-[[2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetyl]amino]acetate
CID 82547812
2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]-N-(4-hydroxycyclohexyl)acetamide
CID 82547666
4-[[2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetyl]amino]butanoic acid
CID 82547802
2-(2-propyl-1,3-thiazol-4-yl)acetamide
CID 89272133
ethyl 4-[2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetyl]piperazine-1-carboxylate
CID 110450870
2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]-N-[2-(diethylamino)ethyl]acetamide
CID 82547658

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide?
The IUPAC name of 2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide (CID 82547702) is 2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide.
What is the SMILES notation for 2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide?
The canonical SMILES for 2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide is CC(N)c1nc(CC(N)=O)cs1.
What is the InChIKey of 2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide?
The InChIKey is UGBJLURRPQNLMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3OS/c1-4(8)7-10-5(3-12-7)2-6(9)11/h3-4H,2,8H2,1H3,(H2,9,11).
What are the key properties of 2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide?
2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide has a molecular weight of 185.25 g/mol, XLogP of 0.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide is sourced from PubChem (CID 82547702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).