2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide

C20H23NO5 — CID 90856781

IUPAC2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide
SMILESCOCOc1ccc(C=Cc2ccc(CC(N)=O)cc2)cc1OCOC
InChIInChI=1S/C20H23NO5/c1-23-13-25-18-10-9-16(11-19(18)26-14-24-2)6-3-15-4-7-17(8-5-15)12-20(21)22/h3-11H,12-14H2,1-2H3,(H2,21,22)
InChIKeyFUVDFXLVKRPLCG-UHFFFAOYSA-N
MW357.41 g/mol
LogP2.85
Rot. Bonds10

About 2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide

2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide (PubChem CID 90856781) has the molecular formula C20H23NO5 and a molecular weight of 357.41 g/mol. Its IUPAC name is 2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide.

Molecular Properties

Compound Name2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide
PubChem CID90856781
Molecular FormulaC20H23NO5
Molecular Weight357.41 g/mol
Exact Mass357.16
IUPAC Name2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide
SMILESCOCOc1ccc(C=Cc2ccc(CC(N)=O)cc2)cc1OCOC
InChIInChI=1S/C20H23NO5/c1-23-13-25-18-10-9-16(11-19(18)26-14-24-2)6-3-15-4-7-17(8-5-15)12-20(21)22/h3-11H,12-14H2,1-2H3,(H2,21,22)
InChIKeyFUVDFXLVKRPLCG-UHFFFAOYSA-N
XLogP2.85
TPSA80.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

1-methoxy-2-(methoxymethoxy)-4-[(E)-2-[4-[(E)-2-[4-methoxy-3-(methoxymethoxy)phenyl]ethenyl]phenyl]ethenyl]benzene
CID 11730255
4-[(E)-2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]benzenesulfonamide
CID 68976551
methyl 4-[4-[3,4-bis(methoxymethoxy)phenyl]buta-1,3-dienyl]benzoate
CID 91216222
1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene
CID 58923294
2-[4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]phenyl]acetamide
CID 68956435
3,4-bis[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]benzoic acid
CID 142209148
3,4-bis(methoxymethoxy)benzaldehyde
CID 11746314
(E)-N-[4-(2-amino-2-oxoethyl)phenyl]-3-(3-ethoxy-4-methoxyphenyl)prop-2-enamide
CID 55620260
1,2-bis(methoxymethoxy)-4-[(1E,3E)-4-(4-nitrophenyl)buta-1,3-dienyl]benzene
CID 87641751
4-ethenyl-1,2-bis(methoxymethoxy)benzene
CID 57430947
[(2E)-3,7-dimethylocta-2,7-dienyl] 4-[(E)-2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]benzoate
CID 57430933
methyl (3Z,6E)-7-[3,4-bis(methoxymethoxy)phenyl]-2,5-dimethylidenehepta-3,6-dienoate
CID 142209177

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide?
The IUPAC name of 2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide (CID 90856781) is 2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide.
What is the SMILES notation for 2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide?
The canonical SMILES for 2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide is COCOc1ccc(C=Cc2ccc(CC(N)=O)cc2)cc1OCOC.
What is the InChIKey of 2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide?
The InChIKey is FUVDFXLVKRPLCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO5/c1-23-13-25-18-10-9-16(11-19(18)26-14-24-2)6-3-15-4-7-17(8-5-15)12-20(21)22/h3-11H,12-14H2,1-2H3,(H2,21,22).
What are the key properties of 2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide?
2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide has a molecular weight of 357.41 g/mol, XLogP of 2.85, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide is sourced from PubChem (CID 90856781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).