N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide

C17H18N2O3S — CID 4801918

IUPACN-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide
SMILESCC(=O)c1sc(NC(=O)COc2ccc3c(c2)CCC3)nc1C
InChIInChI=1S/C17H18N2O3S/c1-10-16(11(2)20)23-17(18-10)19-15(21)9-22-14-7-6-12-4-3-5-13(12)8-14/h6-8H,3-5,9H2,1-2H3,(H,18,19,21)
InChIKeyYNNWDMRMZRNBSK-UHFFFAOYSA-N
MW330.41 g/mol
LogP3.16
Rot. Bonds5

About N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide

N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide (PubChem CID 4801918) has the molecular formula C17H18N2O3S and a molecular weight of 330.41 g/mol. Its IUPAC name is N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide.

Molecular Properties

Compound NameN-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide
PubChem CID4801918
Molecular FormulaC17H18N2O3S
Molecular Weight330.41 g/mol
Exact Mass330.10
IUPAC NameN-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide
SMILESCC(=O)c1sc(NC(=O)COc2ccc3c(c2)CCC3)nc1C
InChIInChI=1S/C17H18N2O3S/c1-10-16(11(2)20)23-17(18-10)19-15(21)9-22-14-7-6-12-4-3-5-13(12)8-14/h6-8H,3-5,9H2,1-2H3,(H,18,19,21)
InChIKeyYNNWDMRMZRNBSK-UHFFFAOYSA-N
XLogP3.16
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(4-ethoxyphenoxy)acetamide
CID 19177786
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(4-chloro-3,5-dimethylphenoxy)acetamide
CID 19178514
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 29369167
2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]acetamide
CID 7921771
ethyl 4-methyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]-1,3-thiazole-5-carboxylate
CID 33169417
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-propan-2-yloxyacetamide
CID 43853851
2-(2,3-dihydro-1H-inden-5-yloxy)-N-[4-(4-propylphenyl)-1,3-thiazol-2-yl]acetamide
CID 5106839
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 115630112
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2-chlorophenoxy)acetamide
CID 19178556
N-(2,3-dihydro-1H-inden-5-yl)-2-(4-methoxyphenoxy)acetamide
CID 2710612
2-(2,3-dihydro-1H-inden-5-yloxy)-N-methoxyacetamide
CID 51275231
N-(2-acetamidoethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide
CID 26655876

Frequently Asked Questions

What is the IUPAC name of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide?
The IUPAC name of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide (CID 4801918) is N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide.
What is the SMILES notation for N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide?
The canonical SMILES for N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide is CC(=O)c1sc(NC(=O)COc2ccc3c(c2)CCC3)nc1C.
What is the InChIKey of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide?
The InChIKey is YNNWDMRMZRNBSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3S/c1-10-16(11(2)20)23-17(18-10)19-15(21)9-22-14-7-6-12-4-3-5-13(12)8-14/h6-8H,3-5,9H2,1-2H3,(H,18,19,21).
What are the key properties of N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide?
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide has a molecular weight of 330.41 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide is sourced from PubChem (CID 4801918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).