N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide

C16H16N4O3S — CID 71931194

IUPACN-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
SMILESCc1noc(COCC(=O)Nc2ncc(Cc3ccccc3)s2)n1
InChIInChI=1S/C16H16N4O3S/c1-11-18-15(23-20-11)10-22-9-14(21)19-16-17-8-13(24-16)7-12-5-3-2-4-6-12/h2-6,8H,7,9-10H2,1H3,(H,17,19,21)
InChIKeyOMULAOBNPZAPSE-UHFFFAOYSA-N
MW344.40 g/mol
LogP2.58
Rot. Bonds7

About N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide

N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide (PubChem CID 71931194) has the molecular formula C16H16N4O3S and a molecular weight of 344.40 g/mol. Its IUPAC name is N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide.

Molecular Properties

Compound NameN-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
PubChem CID71931194
Molecular FormulaC16H16N4O3S
Molecular Weight344.40 g/mol
Exact Mass344.09
IUPAC NameN-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
SMILESCc1noc(COCC(=O)Nc2ncc(Cc3ccccc3)s2)n1
InChIInChI=1S/C16H16N4O3S/c1-11-18-15(23-20-11)10-22-9-14(21)19-16-17-8-13(24-16)7-12-5-3-2-4-6-12/h2-6,8H,7,9-10H2,1H3,(H,17,19,21)
InChIKeyOMULAOBNPZAPSE-UHFFFAOYSA-N
XLogP2.58
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.40
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(5-benzyl-1,3-thiazol-2-yl)-2-(2-methylphenoxy)acetamide
CID 23760784
N-(5-benzyl-1,3-thiazol-2-yl)-2-[(6-methyl-1H-benzimidazol-2-yl)methoxy]acetamide
CID 46968877
2-ethoxy-N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]acetamide
CID 18827616
3-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[5-[[4-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]propanamide
CID 78863035
2-(4-phenylmethoxyphenoxy)-N-[5-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-2-yl]acetamide
CID 18836361
N-(5-benzyl-1,3-thiazol-2-yl)-2-(3-methoxyphenoxy)acetamide
CID 18836083
4-[(5-benzyl-1,3-thiazol-2-yl)amino]-4-oxobutanoic acid
CID 27407164
N-(5-benzyl-1,3-thiazol-2-yl)-2-(2,6-dimethylanilino)acetamide
CID 2240018
N-(5-benzyl-1,3-thiazol-2-yl)-2-(2-methoxy-4-methylphenoxy)acetamide
CID 112767241
N-(5-benzyl-1,3-thiazol-2-yl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
CID 17459661
N-(5-benzyl-1,3-thiazol-2-yl)-2-[4-(1,3-dithiolan-2-yl)phenoxy]acetamide
CID 16559087
4-amino-N-(5-benzyl-1,3-thiazol-2-yl)pentanamide;hydrochloride
CID 120559194

Frequently Asked Questions

What is the IUPAC name of N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
The IUPAC name of N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide (CID 71931194) is N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide.
What is the SMILES notation for N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
The canonical SMILES for N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide is Cc1noc(COCC(=O)Nc2ncc(Cc3ccccc3)s2)n1.
What is the InChIKey of N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
The InChIKey is OMULAOBNPZAPSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O3S/c1-11-18-15(23-20-11)10-22-9-14(21)19-16-17-8-13(24-16)7-12-5-3-2-4-6-12/h2-6,8H,7,9-10H2,1H3,(H,17,19,21).
What are the key properties of N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide has a molecular weight of 344.40 g/mol, XLogP of 2.58, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-benzyl-1,3-thiazol-2-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide is sourced from PubChem (CID 71931194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).