2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide

C14H13N3O2S — CID 103775067

IUPAC2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NCc1csc(=O)[nH]1
InChIInChI=1S/C14H13N3O2S/c18-13(16-7-10-8-20-14(19)17-10)5-9-6-15-12-4-2-1-3-11(9)12/h1-4,6,8,15H,5,7H2,(H,16,18)(H,17,19)
InChIKeyXDDMUKFGZKQZJR-UHFFFAOYSA-N
MW287.34 g/mol
LogP1.78
Rot. Bonds4

About 2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide

2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide (PubChem CID 103775067) has the molecular formula C14H13N3O2S and a molecular weight of 287.34 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide
PubChem CID103775067
Molecular FormulaC14H13N3O2S
Molecular Weight287.34 g/mol
Exact Mass287.07
IUPAC Name2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NCc1csc(=O)[nH]1
InChIInChI=1S/C14H13N3O2S/c18-13(16-7-10-8-20-14(19)17-10)5-9-6-15-12-4-2-1-3-11(9)12/h1-4,6,8,15H,5,7H2,(H,16,18)(H,17,19)
InChIKeyXDDMUKFGZKQZJR-UHFFFAOYSA-N
XLogP1.78
TPSA77.75 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 51.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-hydroxyphenyl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide
CID 103775150
N-[(4-bromothiophen-2-yl)methyl]-2-(1H-indol-3-yl)acetamide
CID 47250258
N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633
N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide
CID 103775054
N-[(2S)-2-hydroxypropyl]-2-(1H-indol-3-yl)acetamide
CID 39248120
N-[(2-fluorophenyl)methyl]-2-(1H-indol-3-yl)acetamide
CID 3562962
2-(1H-indol-3-yl)-N-[[2-(trifluoromethyl)phenyl]methyl]acetamide
CID 20969118
2-(1H-indol-3-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]acetamide
CID 110746414
N-but-2-ynyl-2-(1H-indol-3-yl)acetamide;ethane
CID 143542035
N-hex-5-ynyl-2-(1H-indol-3-yl)acetamide
CID 113256112
N-(imidazo[2,1-b][1,3]thiazol-3-ylmethyl)-2-(1H-indol-3-yl)acetamide
CID 110867045
N-[3-[2-[2-(1H-indol-3-yl)acetyl]hydrazinyl]-3-oxopropyl]thiophene-2-carboxamide
CID 39757148

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide (CID 103775067) is 2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide is O=C(Cc1c[nH]c2ccccc12)NCc1csc(=O)[nH]1.
What is the InChIKey of 2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide?
The InChIKey is XDDMUKFGZKQZJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2S/c18-13(16-7-10-8-20-14(19)17-10)5-9-6-15-12-4-2-1-3-11(9)12/h1-4,6,8,15H,5,7H2,(H,16,18)(H,17,19).
What are the key properties of 2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide?
2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide has a molecular weight of 287.34 g/mol, XLogP of 1.78, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide is sourced from PubChem (CID 103775067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).