2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide

C14H17N3OS — CID 103814835

IUPAC2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide
SMILESCCc1cnc(CNC(=O)C(N)c2ccccc2)s1
InChIInChI=1S/C14H17N3OS/c1-2-11-8-16-12(19-11)9-17-14(18)13(15)10-6-4-3-5-7-10/h3-8,13H,2,9,15H2,1H3,(H,17,18)
InChIKeyXNWMYTODTKTXAL-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.02
Rot. Bonds5

About 2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide

2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide (PubChem CID 103814835) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is 2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide
PubChem CID103814835
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC Name2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide
SMILESCCc1cnc(CNC(=O)C(N)c2ccccc2)s1
InChIInChI=1S/C14H17N3OS/c1-2-11-8-16-12(19-11)9-17-14(18)13(15)10-6-4-3-5-7-10/h3-8,13H,2,9,15H2,1H3,(H,17,18)
InChIKeyXNWMYTODTKTXAL-UHFFFAOYSA-N
XLogP2.02
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-[(5-ethyl-1,3-thiazol-2-yl)methylamino]-2-phenylacetic acid
CID 122038564
2-amino-2-phenyl-N-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)methyl]acetamide
CID 119334068
2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylpropanamide;dihydrochloride
CID 120597319
3-(2-aminophenyl)-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]propanamide;dihydrochloride
CID 120613405
2-bromo-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-3-methylbutanamide
CID 103693152
2-bromo-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]benzamide
CID 103709233
2-amino-2-phenyl-N-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]acetamide;dihydrochloride
CID 119897370
(2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide
CID 62058382
1-(2,2-diphenylethyl)-3-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-methylguanidine;hydroiodide
CID 111516890
(2S)-2-amino-N-[(2-methylpyrimidin-4-yl)methyl]-2-phenylacetamide
CID 93444407
2-amino-N-ethyl-2-phenylacetamide
CID 22262703
(2S)-2-amino-N-[(5-bromothiophen-2-yl)methyl]-2-phenylacetamide
CID 93434478

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide?
The IUPAC name of 2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide (CID 103814835) is 2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide?
The canonical SMILES for 2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide is CCc1cnc(CNC(=O)C(N)c2ccccc2)s1.
What is the InChIKey of 2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide?
The InChIKey is XNWMYTODTKTXAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c1-2-11-8-16-12(19-11)9-17-14(18)13(15)10-6-4-3-5-7-10/h3-8,13H,2,9,15H2,1H3,(H,17,18).
What are the key properties of 2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide?
2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide has a molecular weight of 275.38 g/mol, XLogP of 2.02, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-phenylacetamide is sourced from PubChem (CID 103814835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).