2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide

C13H15N3O2S — CID 63183740

IUPAC2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide
SMILESNc1nc(CC(=O)NC(CO)c2ccccc2)cs1
InChIInChI=1S/C13H15N3O2S/c14-13-15-10(8-19-13)6-12(18)16-11(7-17)9-4-2-1-3-5-9/h1-5,8,11,17H,6-7H2,(H2,14,15)(H,16,18)
InChIKeyLCOSRCCOKPQLHM-UHFFFAOYSA-N
MW277.35 g/mol
LogP1.12
Rot. Bonds5

About 2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide

2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide (PubChem CID 63183740) has the molecular formula C13H15N3O2S and a molecular weight of 277.35 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide
PubChem CID63183740
Molecular FormulaC13H15N3O2S
Molecular Weight277.35 g/mol
Exact Mass277.09
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide
SMILESNc1nc(CC(=O)NC(CO)c2ccccc2)cs1
InChIInChI=1S/C13H15N3O2S/c14-13-15-10(8-19-13)6-12(18)16-11(7-17)9-4-2-1-3-5-9/h1-5,8,11,17H,6-7H2,(H2,14,15)(H,16,18)
InChIKeyLCOSRCCOKPQLHM-UHFFFAOYSA-N
XLogP1.12
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 51.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-2-phenylpropanoic acid
CID 62884193
N-[(1R)-2-hydroxy-1-phenylethyl]-2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetamide
CID 51824517
2-(2-amino-1,3-thiazol-4-yl)-N-(3-phenylbutyl)acetamide
CID 62987863
2-(4-aminophenyl)-N-(2-hydroxy-1-phenylethyl)acetamide
CID 63184600
2-[4-(aminomethyl)phenyl]-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide
CID 107861946
2-[2-(aminomethyl)phenyl]-N-(2-hydroxy-1-phenylethyl)acetamide
CID 81312733
2-(2-amino-1,3-thiazol-4-yl)-N-[1-(2-methylphenyl)ethyl]acetamide
CID 62798043
2-(2-amino-1,3-thiazol-4-yl)-N-benzylacetamide
CID 39733641
2-(2-amino-1,3-thiazol-4-yl)-N-pentan-3-ylacetamide
CID 62797095
2-(2-amino-1,3-thiazol-4-yl)-N-[1-(2-fluorophenyl)ethyl]acetamide
CID 62798369
2-(2-amino-1,3-thiazol-4-yl)-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 62799997
2-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]propanamide
CID 62798707

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide (CID 63183740) is 2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide is Nc1nc(CC(=O)NC(CO)c2ccccc2)cs1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide?
The InChIKey is LCOSRCCOKPQLHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2S/c14-13-15-10(8-19-13)6-12(18)16-11(7-17)9-4-2-1-3-5-9/h1-5,8,11,17H,6-7H2,(H2,14,15)(H,16,18).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide?
2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide has a molecular weight of 277.35 g/mol, XLogP of 1.12, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-N-(2-hydroxy-1-phenylethyl)acetamide is sourced from PubChem (CID 63183740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).