N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide

C14H14N2O2S — CID 951103

IUPACN-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide
SMILESCOc1ccccc1C=NNC(=O)Cc1cccs1
InChIInChI=1S/C14H14N2O2S/c1-18-13-7-3-2-5-11(13)10-15-16-14(17)9-12-6-4-8-19-12/h2-8,10H,9H2,1H3,(H,16,17)
InChIKeyFYWIOIBUPSXESW-UHFFFAOYSA-N
MW274.35 g/mol
LogP2.45
Rot. Bonds5

About N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide

N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide (PubChem CID 951103) has the molecular formula C14H14N2O2S and a molecular weight of 274.35 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide
PubChem CID951103
Molecular FormulaC14H14N2O2S
Molecular Weight274.35 g/mol
Exact Mass274.08
IUPAC NameN-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide
SMILESCOc1ccccc1C=NNC(=O)Cc1cccs1
InChIInChI=1S/C14H14N2O2S/c1-18-13-7-3-2-5-11(13)10-15-16-14(17)9-12-6-4-8-19-12/h2-8,10H,9H2,1H3,(H,16,17)
InChIKeyFYWIOIBUPSXESW-UHFFFAOYSA-N
XLogP2.45
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 52.45
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

N-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]-2-thiophen-2-ylacetamide
CID 7516704
N-[(E)-(2,3-dibromo-4-hydroxy-5-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide
CID 135684249
N-(naphthalen-1-ylmethylideneamino)-2-thiophen-2-ylacetamide
CID 2064176
N-[(E)-naphthalen-1-ylmethylideneamino]-2-thiophen-2-ylacetamide
CID 6893906
N-[(Z)-(4-hydroxy-3-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide
CID 135905133
N-[(4-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide
CID 929721
2-(4-hydroxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]acetamide
CID 110515533
N-[(E)-(2,3-dihydroxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide
CID 135680361
N-[(Z)-(3,5-dibromo-2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide
CID 92699107
N-[(Z)-[3-ethoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl]methylideneamino]-2-thiophen-2-ylacetamide
CID 126209978
N-[(Z)-(3-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide
CID 5425302
N-[(Z)-[3-methoxy-4-(2-methoxyethoxy)phenyl]methylideneamino]-2-thiophen-2-ylacetamide
CID 126213621

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide (CID 951103) is N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide is COc1ccccc1C=NNC(=O)Cc1cccs1.
What is the InChIKey of N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide?
The InChIKey is FYWIOIBUPSXESW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2S/c1-18-13-7-3-2-5-11(13)10-15-16-14(17)9-12-6-4-8-19-12/h2-8,10H,9H2,1H3,(H,16,17).
What are the key properties of N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide?
N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide has a molecular weight of 274.35 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methylideneamino]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 951103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).