N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide

C17H15FN2O2 — CID 9317079

IUPACN-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide
SMILESO=C(COc1ccccc1F)NN=C1Cc2ccccc2C1
InChIInChI=1S/C17H15FN2O2/c18-15-7-3-4-8-16(15)22-11-17(21)20-19-14-9-12-5-1-2-6-13(12)10-14/h1-8H,9-11H2,(H,20,21)
InChIKeySWSCANJXGQECIB-UHFFFAOYSA-N
MW298.32 g/mol
LogP2.48
Rot. Bonds4

About N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide

N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide (PubChem CID 9317079) has the molecular formula C17H15FN2O2 and a molecular weight of 298.32 g/mol. Its IUPAC name is N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide
PubChem CID9317079
Molecular FormulaC17H15FN2O2
Molecular Weight298.32 g/mol
Exact Mass298.11
IUPAC NameN-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide
SMILESO=C(COc1ccccc1F)NN=C1Cc2ccccc2C1
InChIInChI=1S/C17H15FN2O2/c18-15-7-3-4-8-16(15)22-11-17(21)20-19-14-9-12-5-1-2-6-13(12)10-14/h1-8H,9-11H2,(H,20,21)
InChIKeySWSCANJXGQECIB-UHFFFAOYSA-N
XLogP2.48
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.32
LogP ≤ 52.48
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

2-(2-chlorophenoxy)-N-(1,3-dihydroinden-2-ylideneamino)acetamide
CID 4923025
2-(4-bromo-2-chlorophenoxy)-N-(1,3-dihydroinden-2-ylideneamino)acetamide
CID 4923053
2-(2-fluorophenoxy)-N-[(Z)-(2-oxoacenaphthylen-1-ylidene)amino]acetamide
CID 6173888
N-(2,6-difluorophenyl)-2-(2-fluorophenoxy)acetamide
CID 892688
2-(2-fluorophenoxy)-N'-(2-methylsulfanylacetyl)acetohydrazide
CID 9471875
2-(2-fluorophenoxy)-N-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)amino]acetamide
CID 74042000
N-[(Z)-3,4-dihydro-1H-naphthalen-2-ylideneamino]-2-(2-fluorophenyl)sulfanylacetamide
CID 9410856
N-[(2-bromophenyl)methylideneamino]-2-(2-fluorophenoxy)acetamide
CID 2695035
2-(2-methoxyphenoxy)-N-[(4-methylcyclohexylidene)amino]acetamide
CID 9315773
2-(2-fluorophenoxy)-N-[(Z)-(4-methylphenyl)methylideneamino]acetamide
CID 7787134
N-ethoxy-2-(2-fluorophenoxy)acetamide
CID 60712120
2-(2-fluorophenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide
CID 3895307

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide?
The IUPAC name of N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide (CID 9317079) is N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide.
What is the SMILES notation for N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide?
The canonical SMILES for N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide is O=C(COc1ccccc1F)NN=C1Cc2ccccc2C1.
What is the InChIKey of N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide?
The InChIKey is SWSCANJXGQECIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O2/c18-15-7-3-4-8-16(15)22-11-17(21)20-19-14-9-12-5-1-2-6-13(12)10-14/h1-8H,9-11H2,(H,20,21).
What are the key properties of N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide?
N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide has a molecular weight of 298.32 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dihydroinden-2-ylideneamino)-2-(2-fluorophenoxy)acetamide is sourced from PubChem (CID 9317079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).