2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide

C19H17N3O3S — CID 24524444

IUPAC2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide
SMILESNC(=O)COc1ccccc1C(=O)/N=c1/sccn1Cc1ccccc1
InChIInChI=1S/C19H17N3O3S/c20-17(23)13-25-16-9-5-4-8-15(16)18(24)21-19-22(10-11-26-19)12-14-6-2-1-3-7-14/h1-11H,12-13H2,(H2,20,23)/b21-19+
InChIKeyLEQOFBVMMGQGDM-XUTLUUPISA-N
MW367.43 g/mol
LogP2.20
Rot. Bonds6

About 2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide

2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide (PubChem CID 24524444) has the molecular formula C19H17N3O3S and a molecular weight of 367.43 g/mol. Its IUPAC name is 2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide.

Molecular Properties

Compound Name2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide
PubChem CID24524444
Molecular FormulaC19H17N3O3S
Molecular Weight367.43 g/mol
Exact Mass367.10
IUPAC Name2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide
SMILESNC(=O)COc1ccccc1C(=O)/N=c1/sccn1Cc1ccccc1
InChIInChI=1S/C19H17N3O3S/c20-17(23)13-25-16-9-5-4-8-15(16)18(24)21-19-22(10-11-26-19)12-14-6-2-1-3-7-14/h1-11H,12-13H2,(H2,20,23)/b21-19+
InChIKeyLEQOFBVMMGQGDM-XUTLUUPISA-N
XLogP2.20
TPSA86.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.43
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-benzyl-1,3-thiazol-2-ylidene)-2-phenyl-1,3-thiazole-4-carboxamide
CID 18293281
N-(3-benzyl-1,3-thiazol-2-ylidene)-3-methyl-1,2-oxazole-5-carboxamide
CID 38272852
N-(3-benzyl-1,3-thiazol-2-ylidene)-3-methyl-4-oxophthalazine-1-carboxamide
CID 9194190
N-(3-benzyl-1,3-thiazol-2-ylidene)-4,6,7-trimethoxy-1H-indole-2-carboxamide
CID 38486353
N-(3-benzyl-1,3-thiazol-2-ylidene)-3,6-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 24607678
2-[2-(2-fluoroanilino)-2-oxoethoxy]-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide
CID 31304870
[2-[[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]amino]-2-oxoethyl] 2-(methylamino)benzoate
CID 7671059
N-(3-benzyl-1,3-thiazol-2-ylidene)-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 18269929
2,4-difluoro-N-[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]benzamide
CID 7930653
2-(2-amino-2-oxoethoxy)-N-[(1-benzylpiperidin-4-yl)methyl]benzamide
CID 47920766
[2-(4-benzylpiperazin-1-yl)-2-oxoethyl] 2-(2-amino-2-oxoethoxy)benzoate
CID 55479799
(2S)-N-(3-benzyl-1,3-thiazol-2-ylidene)-1-methylsulfonylpyrrolidine-2-carboxamide
CID 32621992

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide?
The IUPAC name of 2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide (CID 24524444) is 2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide.
What is the SMILES notation for 2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide?
The canonical SMILES for 2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide is NC(=O)COc1ccccc1C(=O)/N=c1/sccn1Cc1ccccc1.
What is the InChIKey of 2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide?
The InChIKey is LEQOFBVMMGQGDM-XUTLUUPISA-N. The full InChI is InChI=1S/C19H17N3O3S/c20-17(23)13-25-16-9-5-4-8-15(16)18(24)21-19-22(10-11-26-19)12-14-6-2-1-3-7-14/h1-11H,12-13H2,(H2,20,23)/b21-19+.
What are the key properties of 2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide?
2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide has a molecular weight of 367.43 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-2-oxoethoxy)-N-(3-benzyl-1,3-thiazol-2-ylidene)benzamide is sourced from PubChem (CID 24524444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).