2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide

C18H16N2O2S — CID 5406666

IUPAC2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide
SMILESC/C(=N/NC(=O)COc1cccc2ccccc12)c1cccs1
InChIInChI=1S/C18H16N2O2S/c1-13(17-10-5-11-23-17)19-20-18(21)12-22-16-9-4-7-14-6-2-3-8-15(14)16/h2-11H,12H2,1H3,(H,20,21)/b19-13-
InChIKeyZZMKSPISXRSTPS-UYRXBGFRSA-N
MW324.41 g/mol
LogP3.82
Rot. Bonds5

About 2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide

2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide (PubChem CID 5406666) has the molecular formula C18H16N2O2S and a molecular weight of 324.41 g/mol. Its IUPAC name is 2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide.

Molecular Properties

Compound Name2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide
PubChem CID5406666
Molecular FormulaC18H16N2O2S
Molecular Weight324.41 g/mol
Exact Mass324.09
IUPAC Name2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide
SMILESC/C(=N/NC(=O)COc1cccc2ccccc12)c1cccs1
InChIInChI=1S/C18H16N2O2S/c1-13(17-10-5-11-23-17)19-20-18(21)12-22-16-9-4-7-14-6-2-3-8-15(14)16/h2-11H,12H2,1H3,(H,20,21)/b19-13-
InChIKeyZZMKSPISXRSTPS-UYRXBGFRSA-N
XLogP3.82
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.41
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-naphthalen-1-yloxy-N-[(Z)-1-phenylethylideneamino]acetamide
CID 5404956
N-[1-(3-aminophenyl)ethylideneamino]-2-naphthalen-1-yloxyacetamide
CID 922110
2-(4-tert-butylphenoxy)-N-(1-thiophen-2-ylethylideneamino)acetamide
CID 4564846
2-(4-methyl-2-propan-2-ylphenoxy)-N-(1-thiophen-2-ylethylideneamino)acetamide
CID 3495541
2-phenyl-N-[(E)-1-thiophen-2-ylethylideneamino]acetamide
CID 6116253
3-naphthalen-1-yl-N-(1-thiophen-2-ylethylideneamino)-1H-pyrazole-5-carboxamide
CID 1386855
N,N'-bis[(E)-1-thiophen-2-ylethylideneamino]heptanediamide
CID 19685885
N-[(2-methyl-1-phenylpropylidene)amino]-2-naphthalen-1-yloxyacetamide
CID 3255035
N'-acetyl-2-naphthalen-1-yloxyacetohydrazide
CID 922179
2-indol-1-yl-N-[(E)-1-thiophen-2-ylethylideneamino]acetamide
CID 17080231
N-[(Z)-1-(5-bromothiophen-2-yl)ethylideneamino]-2-(2-fluorophenoxy)acetamide
CID 9316947
N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide
CID 5035424

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide?
The IUPAC name of 2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide (CID 5406666) is 2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide.
What is the SMILES notation for 2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide?
The canonical SMILES for 2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide is C/C(=N/NC(=O)COc1cccc2ccccc12)c1cccs1.
What is the InChIKey of 2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide?
The InChIKey is ZZMKSPISXRSTPS-UYRXBGFRSA-N. The full InChI is InChI=1S/C18H16N2O2S/c1-13(17-10-5-11-23-17)19-20-18(21)12-22-16-9-4-7-14-6-2-3-8-15(14)16/h2-11H,12H2,1H3,(H,20,21)/b19-13-.
What are the key properties of 2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide?
2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide has a molecular weight of 324.41 g/mol, XLogP of 3.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yloxy-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide is sourced from PubChem (CID 5406666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).