N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide

C16H16N2OS — CID 9410892

IUPACN-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)N/N=C1/CCc2ccccc2C1
InChIInChI=1S/C16H16N2OS/c19-16(11-15-6-3-9-20-15)18-17-14-8-7-12-4-1-2-5-13(12)10-14/h1-6,9H,7-8,10-11H2,(H,18,19)/b17-14-
InChIKeyFUMSTXHZBMZOFE-VKAVYKQESA-N
MW284.38 g/mol
LogP2.95
Rot. Bonds3

About N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide

N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide (PubChem CID 9410892) has the molecular formula C16H16N2OS and a molecular weight of 284.38 g/mol. Its IUPAC name is N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide
PubChem CID9410892
Molecular FormulaC16H16N2OS
Molecular Weight284.38 g/mol
Exact Mass284.10
IUPAC NameN-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)N/N=C1/CCc2ccccc2C1
InChIInChI=1S/C16H16N2OS/c19-16(11-15-6-3-9-20-15)18-17-14-8-7-12-4-1-2-5-13(12)10-14/h1-6,9H,7-8,10-11H2,(H,18,19)/b17-14-
InChIKeyFUMSTXHZBMZOFE-VKAVYKQESA-N
XLogP2.95
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 52.95
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

1,3-bis[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]urea
CID 5467984
N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-(2-fluorophenyl)sulfanylacetamide
CID 9410856
N-(1,3-dihydroinden-2-ylideneamino)thiophene-2-carboxamide
CID 4923007
2-thiophen-2-yl-N-[2-[(2-thiophen-2-ylacetyl)amino]ethyl]acetamide
CID 25146649
N-[(E)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-1,3-benzodioxole-5-carboxamide
CID 9410613
N-[(E)-pyridin-2-ylmethylideneamino]-2-thiophen-2-ylacetamide
CID 6862493
2-thiophen-2-yl-N-(thiophen-2-ylmethyl)acetamide
CID 1245174
N-(1-naphthalen-2-ylethylideneamino)-2-thiophen-2-ylacetamide
CID 951064
2-[2-[[(2-thiophen-2-ylacetyl)amino]methyl]phenyl]acetic acid
CID 81318404
N'-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-N-(4-methylphenyl)oxamide
CID 9410894
N-[(E)-1-(4-phenylphenyl)ethylideneamino]-2-thiophen-2-ylacetamide
CID 7462993
N-[(E)-naphthalen-1-ylmethylideneamino]-2-thiophen-2-ylacetamide
CID 6893906

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide (CID 9410892) is N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)N/N=C1/CCc2ccccc2C1.
What is the InChIKey of N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide?
The InChIKey is FUMSTXHZBMZOFE-VKAVYKQESA-N. The full InChI is InChI=1S/C16H16N2OS/c19-16(11-15-6-3-9-20-15)18-17-14-8-7-12-4-1-2-5-13(12)10-14/h1-6,9H,7-8,10-11H2,(H,18,19)/b17-14-.
What are the key properties of N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide?
N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide has a molecular weight of 284.38 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 9410892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).