N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide

C20H18N2O4 — CID 1389238

IUPACN-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide
SMILESCOc1ccc(C=NNC(=O)c2ccco2)cc1OCc1ccccc1
InChIInChI=1S/C20H18N2O4/c1-24-17-10-9-16(13-21-22-20(23)18-8-5-11-25-18)12-19(17)26-14-15-6-3-2-4-7-15/h2-13H,14H2,1H3,(H,22,23)
InChIKeyKIQMEQQCBMVALT-UHFFFAOYSA-N
MW350.37 g/mol
LogP3.63
Rot. Bonds7

About N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide

N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide (PubChem CID 1389238) has the molecular formula C20H18N2O4 and a molecular weight of 350.37 g/mol. Its IUPAC name is N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide
PubChem CID1389238
Molecular FormulaC20H18N2O4
Molecular Weight350.37 g/mol
Exact Mass350.13
IUPAC NameN-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide
SMILESCOc1ccc(C=NNC(=O)c2ccco2)cc1OCc1ccccc1
InChIInChI=1S/C20H18N2O4/c1-24-17-10-9-16(13-21-22-20(23)18-8-5-11-25-18)12-19(17)26-14-15-6-3-2-4-7-15/h2-13H,14H2,1H3,(H,22,23)
InChIKeyKIQMEQQCBMVALT-UHFFFAOYSA-N
XLogP3.63
TPSA73.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.37
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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-[[3,4-bis(phenylmethoxy)phenyl]methylideneamino]furan-2-carboxamide
CID 2336578
N-[(E)-[4-[(4-bromophenyl)methoxy]-3-methoxyphenyl]methylideneamino]furan-2-carboxamide
CID 21370277
methyl 4-[[4-[(Z)-(furan-2-carbonylhydrazinylidene)methyl]-2-methoxyphenoxy]methyl]benzoate
CID 9175476
3,4,5-trimethoxy-N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]benzamide
CID 42991313
N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]-1-benzofuran-2-carboxamide
CID 96885314
N-(furan-2-ylmethyl)-N'-[(Z)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide
CID 9352883
N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide
CID 6910290
3-hydroxy-N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]benzamide
CID 6911475
N-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylideneamino]furan-2-carboxamide
CID 135642156
N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide
CID 6880344
ethyl N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]carbamate
CID 6902975
3-chloro-N-[(Z)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]benzamide
CID 94847745

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide?
The IUPAC name of N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide (CID 1389238) is N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide.
What is the SMILES notation for N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide?
The canonical SMILES for N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide is COc1ccc(C=NNC(=O)c2ccco2)cc1OCc1ccccc1.
What is the InChIKey of N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide?
The InChIKey is KIQMEQQCBMVALT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O4/c1-24-17-10-9-16(13-21-22-20(23)18-8-5-11-25-18)12-19(17)26-14-15-6-3-2-4-7-15/h2-13H,14H2,1H3,(H,22,23).
What are the key properties of N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide?
N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide has a molecular weight of 350.37 g/mol, XLogP of 3.63, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide is sourced from PubChem (CID 1389238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).