2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide

C11H18N2O2S — CID 110903716

IUPAC2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide
SMILESCCc1nc(CC(=O)NC(CC)CO)cs1
InChIInChI=1S/C11H18N2O2S/c1-3-8(6-14)12-10(15)5-9-7-16-11(4-2)13-9/h7-8,14H,3-6H2,1-2H3,(H,12,15)
InChIKeyOMGQFEPWOFKWGB-UHFFFAOYSA-N
MW242.34 g/mol
LogP1.14
Rot. Bonds6

About 2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide

2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide (PubChem CID 110903716) has the molecular formula C11H18N2O2S and a molecular weight of 242.34 g/mol. Its IUPAC name is 2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide
PubChem CID110903716
Molecular FormulaC11H18N2O2S
Molecular Weight242.34 g/mol
Exact Mass242.11
IUPAC Name2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide
SMILESCCc1nc(CC(=O)NC(CC)CO)cs1
InChIInChI=1S/C11H18N2O2S/c1-3-8(6-14)12-10(15)5-9-7-16-11(4-2)13-9/h7-8,14H,3-6H2,1-2H3,(H,12,15)
InChIKeyOMGQFEPWOFKWGB-UHFFFAOYSA-N
XLogP1.14
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.34
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(1-amino-2-methylpropyl)-1,3-thiazol-4-yl]-N-(1-hydroxybutan-2-yl)acetamide
CID 82547902
2-[[2-(2-ethyl-1,3-thiazol-4-yl)acetyl]amino]butanoic acid
CID 119224070
N-[(2S)-1-hydroxybutan-2-yl]-2-[2-(methanesulfonamido)-1,3-thiazol-4-yl]acetamide
CID 93041415
N-(1-hydroxybutan-2-yl)-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide
CID 43418004
2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide
CID 130662599
2-(2-amino-1,3-thiazol-4-yl)-N-pentan-3-ylacetamide
CID 62797095
2-(2-ethyl-1,3-thiazol-4-yl)-N-[1-(4-fluorophenoxy)propan-2-yl]acetamide
CID 86832332
N-[(1R)-1-(2,5-dimethylfuran-3-yl)ethyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide
CID 94214954
methyl 2-[2-[2-(1-hydroxybutan-2-ylamino)ethyl]-1,3-thiazol-4-yl]acetate
CID 82103021
N-[(2S)-1-[4-(dimethylamino)phenyl]propan-2-yl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide
CID 95293677
2-[[2-[2-(aminomethyl)-1,3-thiazol-4-yl]acetyl]amino]-3-hydroxypropanoic acid
CID 82547773
N-[(2-ethyl-1,3-thiazol-4-yl)methyl]pentan-3-amine
CID 60727178

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide?
The IUPAC name of 2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide (CID 110903716) is 2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide.
What is the SMILES notation for 2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide?
The canonical SMILES for 2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide is CCc1nc(CC(=O)NC(CC)CO)cs1.
What is the InChIKey of 2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide?
The InChIKey is OMGQFEPWOFKWGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2S/c1-3-8(6-14)12-10(15)5-9-7-16-11(4-2)13-9/h7-8,14H,3-6H2,1-2H3,(H,12,15).
What are the key properties of 2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide?
2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide has a molecular weight of 242.34 g/mol, XLogP of 1.14, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide is sourced from PubChem (CID 110903716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).