N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide

C18H16N2OS — CID 951064

IUPACN-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide
SMILESCC(=NNC(=O)Cc1cccs1)c1ccc2ccccc2c1
InChIInChI=1S/C18H16N2OS/c1-13(19-20-18(21)12-17-7-4-10-22-17)15-9-8-14-5-2-3-6-16(14)11-15/h2-11H,12H2,1H3,(H,20,21)
InChIKeyURSUFAVNOCRCLT-UHFFFAOYSA-N
MW308.41 g/mol
LogP3.98
Rot. Bonds4

About N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide

N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide (PubChem CID 951064) has the molecular formula C18H16N2OS and a molecular weight of 308.41 g/mol. Its IUPAC name is N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide
PubChem CID951064
Molecular FormulaC18H16N2OS
Molecular Weight308.41 g/mol
Exact Mass308.10
IUPAC NameN-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide
SMILESCC(=NNC(=O)Cc1cccs1)c1ccc2ccccc2c1
InChIInChI=1S/C18H16N2OS/c1-13(19-20-18(21)12-17-7-4-10-22-17)15-9-8-14-5-2-3-6-16(14)11-15/h2-11H,12H2,1H3,(H,20,21)
InChIKeyURSUFAVNOCRCLT-UHFFFAOYSA-N
XLogP3.98
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.41
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

N-[(E)-1-(4-phenylphenyl)ethylideneamino]-2-thiophen-2-ylacetamide
CID 7462993
N-[(Z)-1-(3,4-dimethoxyphenyl)ethylideneamino]-2-thiophen-2-ylacetamide
CID 5425405
N-[(Z)-1-(3-bromophenyl)ethylideneamino]-2-thiophen-2-ylacetamide
CID 5425293
N-[(Z)-1-pyridin-4-ylethylideneamino]-2-thiophen-2-ylacetamide
CID 5393099
N-[(Z)-1-(3-acetamidophenyl)ethylideneamino]-2-thiophen-2-ylacetamide
CID 7516727
N,N'-bis[(Z)-1-naphthalen-2-ylethylideneamino]nonanediamide
CID 92652613
N,N'-bis(1-naphthalen-2-ylethylideneamino)octanediamide
CID 4172674
N-(1-naphthalen-2-ylethylideneamino)-2-(4-nitrophenyl)acetamide
CID 5201296
N-(1-naphthalen-2-ylethylideneamino)-2-phenoxyacetamide
CID 913446
N-[(E)-1-(2-hydroxy-5-methoxyphenyl)ethylideneamino]-2-thiophen-2-ylacetamide
CID 135680368
N-[(E)-1-(4-hydroxyphenyl)propylideneamino]-2-thiophen-2-ylacetamide
CID 135603281
4-chloro-N-[2-[(2Z)-2-(1-naphthalen-2-ylethylidene)hydrazinyl]-2-oxoethyl]benzamide
CID 6063456

Frequently Asked Questions

What is the IUPAC name of N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide (CID 951064) is N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide is CC(=NNC(=O)Cc1cccs1)c1ccc2ccccc2c1.
What is the InChIKey of N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide?
The InChIKey is URSUFAVNOCRCLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2OS/c1-13(19-20-18(21)12-17-7-4-10-22-17)15-9-8-14-5-2-3-6-16(14)11-15/h2-11H,12H2,1H3,(H,20,21).
What are the key properties of N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide?
N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide has a molecular weight of 308.41 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 951064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).