2-(2-propyl-1,3-thiazol-4-yl)acetamide

C8H12N2OS — CID 89272133

IUPAC2-(2-propyl-1,3-thiazol-4-yl)acetamide
SMILESCCCc1nc(CC(N)=O)cs1
InChIInChI=1S/C8H12N2OS/c1-2-3-8-10-6(5-12-8)4-7(9)11/h5H,2-4H2,1H3,(H2,9,11)
InChIKeyNBILEQKLBRWSHK-UHFFFAOYSA-N
MW184.26 g/mol
LogP1.12
Rot. Bonds4

About 2-(2-propyl-1,3-thiazol-4-yl)acetamide

2-(2-propyl-1,3-thiazol-4-yl)acetamide (PubChem CID 89272133) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is 2-(2-propyl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(2-propyl-1,3-thiazol-4-yl)acetamide
PubChem CID89272133
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC Name2-(2-propyl-1,3-thiazol-4-yl)acetamide
SMILESCCCc1nc(CC(N)=O)cs1
InChIInChI=1S/C8H12N2OS/c1-2-3-8-10-6(5-12-8)4-7(9)11/h5H,2-4H2,1H3,(H2,9,11)
InChIKeyNBILEQKLBRWSHK-UHFFFAOYSA-N
XLogP1.12
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;2-(2-propyl-1,3-thiazol-4-yl)acetamide
CID 143669035
2-(4-ethyl-1,3-thiazol-2-yl)acetamide
CID 116970126
2-[2-(5-aminopentyl)-1,3-thiazol-4-yl]acetamide
CID 82547698
(2-propyl-1,3-thiazol-4-yl)methanamine;hydrochloride
CID 50944167
2-amino-3-(2-propyl-1,3-thiazol-4-yl)propanoic acid
CID 116890720
2-[2-[2-(ethylamino)ethyl]-1,3-thiazol-4-yl]acetic acid
CID 94256908
2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetamide
CID 82547702
2-[2-(aminomethyl)-1,3-thiazol-4-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide
CID 82547498
4-(methylsulfonylmethyl)-2-propyl-1,3-thiazole
CID 137320865
ethyl 2-[2-(3-aminopropyl)-1,3-thiazol-4-yl]acetate
CID 107380154
N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide
CID 51076387
ethyl 2-[2-(4-aminobutyl)-1,3-thiazol-4-yl]acetate
CID 107380238

Frequently Asked Questions

What is the IUPAC name of 2-(2-propyl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of 2-(2-propyl-1,3-thiazol-4-yl)acetamide (CID 89272133) is 2-(2-propyl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for 2-(2-propyl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for 2-(2-propyl-1,3-thiazol-4-yl)acetamide is CCCc1nc(CC(N)=O)cs1.
What is the InChIKey of 2-(2-propyl-1,3-thiazol-4-yl)acetamide?
The InChIKey is NBILEQKLBRWSHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-2-3-8-10-6(5-12-8)4-7(9)11/h5H,2-4H2,1H3,(H2,9,11).
What are the key properties of 2-(2-propyl-1,3-thiazol-4-yl)acetamide?
2-(2-propyl-1,3-thiazol-4-yl)acetamide has a molecular weight of 184.26 g/mol, XLogP of 1.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propyl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 89272133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).