4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide

C20H24N2O2 — CID 6370113

IUPAC4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide
SMILESCCCCC/C(=N\NC(=O)c1ccc(OC)cc1)c1ccccc1
InChIInChI=1S/C20H24N2O2/c1-3-4-6-11-19(16-9-7-5-8-10-16)21-22-20(23)17-12-14-18(24-2)15-13-17/h5,7-10,12-15H,3-4,6,11H2,1-2H3,(H,22,23)/b21-19+
InChIKeyUEULODJADDRXCV-XUTLUUPISA-N
MW324.42 g/mol
LogP4.41
Rot. Bonds8

About 4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide

4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide (PubChem CID 6370113) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide
PubChem CID6370113
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide
SMILESCCCCC/C(=N\NC(=O)c1ccc(OC)cc1)c1ccccc1
InChIInChI=1S/C20H24N2O2/c1-3-4-6-11-19(16-9-7-5-8-10-16)21-22-20(23)17-12-14-18(24-2)15-13-17/h5,7-10,12-15H,3-4,6,11H2,1-2H3,(H,22,23)/b21-19+
InChIKeyUEULODJADDRXCV-XUTLUUPISA-N
XLogP4.41
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(Z)-1-phenylhexylideneamino]-4-phenylmethoxybenzamide
CID 6234100
N-(1-phenylhexylideneamino)-4-phenylmethoxybenzamide
CID 4933075
4-hexoxy-N-(1-phenylpentylideneamino)benzamide
CID 4930589
4-ethoxy-N-(1-phenylpentylideneamino)benzamide
CID 5197608
N-(1-phenylhexylideneamino)pyridine-4-carboxamide
CID 2838403
4-(pentanoylamino)-N-(1-phenylhexylideneamino)benzamide
CID 4926193
2-(4-methoxyphenoxy)-N-(1-phenylpentylideneamino)acetamide
CID 3559145
methyl N-[(Z)-1-phenylhexadecylideneamino]carbamate
CID 127261696
2-methoxy-N-(1-phenylpentylideneamino)benzamide
CID 4692149
N-[1-(4-methoxyphenyl)propylideneamino]-4-phenylbenzamide
CID 5000617
N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide
CID 6004456
N-[(E)-1-phenylhexylideneamino]pyridine-3-carboxamide
CID 5337549

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide?
The IUPAC name of 4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide (CID 6370113) is 4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide.
What is the SMILES notation for 4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide?
The canonical SMILES for 4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide is CCCCC/C(=N\NC(=O)c1ccc(OC)cc1)c1ccccc1.
What is the InChIKey of 4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide?
The InChIKey is UEULODJADDRXCV-XUTLUUPISA-N. The full InChI is InChI=1S/C20H24N2O2/c1-3-4-6-11-19(16-9-7-5-8-10-16)21-22-20(23)17-12-14-18(24-2)15-13-17/h5,7-10,12-15H,3-4,6,11H2,1-2H3,(H,22,23)/b21-19+.
What are the key properties of 4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide?
4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide has a molecular weight of 324.42 g/mol, XLogP of 4.41, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide is sourced from PubChem (CID 6370113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).