N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide

C24H23N3O4 — CID 9359242

IUPACN-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)N/N=C(/C)c2ccc(OCC(=O)Nc3ccccc3)cc2)cc1
InChIInChI=1S/C24H23N3O4/c1-17(26-27-24(29)19-10-12-21(30-2)13-11-19)18-8-14-22(15-9-18)31-16-23(28)25-20-6-4-3-5-7-20/h3-15H,16H2,1-2H3,(H,25,28)(H,27,29)/b26-17-
InChIKeySQOUNBXPRIRVOW-ONUIUJJFSA-N
MW417.47 g/mol
LogP3.87
Rot. Bonds8

About N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide

N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide (PubChem CID 9359242) has the molecular formula C24H23N3O4 and a molecular weight of 417.47 g/mol. Its IUPAC name is N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide
PubChem CID9359242
Molecular FormulaC24H23N3O4
Molecular Weight417.47 g/mol
Exact Mass417.17
IUPAC NameN-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)N/N=C(/C)c2ccc(OCC(=O)Nc3ccccc3)cc2)cc1
InChIInChI=1S/C24H23N3O4/c1-17(26-27-24(29)19-10-12-21(30-2)13-11-19)18-8-14-22(15-9-18)31-16-23(28)25-20-6-4-3-5-7-20/h3-15H,16H2,1-2H3,(H,25,28)(H,27,29)/b26-17-
InChIKeySQOUNBXPRIRVOW-ONUIUJJFSA-N
XLogP3.87
TPSA89.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.47
LogP ≤ 53.87
H-Bond Donors ≤ 52
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-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]benzamide
CID 9058750
methyl N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]carbamate
CID 9075161
4-benzamido-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide
CID 3289478
N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]furan-2-carboxamide
CID 9175372
N-[(Z)-(4-anilino-4-oxobutan-2-ylidene)amino]-4-methoxybenzamide
CID 6382258
N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-4-phenylbenzamide
CID 5496134
4-[[2-(4-methoxyphenoxy)acetyl]amino]-N-(4-methoxyphenyl)benzamide
CID 2710766
4-(2-anilino-2-oxoethoxy)-N-phenylbenzamide
CID 10545541
N-[1-(4-methoxyphenyl)ethylideneamino]-4-prop-2-enoxybenzamide
CID 4925777
N-[1-(4-hydroxyphenyl)ethylideneamino]-2-(4-methoxyphenoxy)acetamide
CID 914096
4-methoxy-N-[(Z)-[4-[2-(4-methoxyanilino)-2-oxoethoxy]phenyl]methylideneamino]benzamide
CID 92850497
N-[1-(4-ethoxyphenyl)ethylideneamino]benzamide
CID 912000

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide?
The IUPAC name of N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide (CID 9359242) is N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide.
What is the SMILES notation for N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide?
The canonical SMILES for N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide is COc1ccc(C(=O)N/N=C(/C)c2ccc(OCC(=O)Nc3ccccc3)cc2)cc1.
What is the InChIKey of N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide?
The InChIKey is SQOUNBXPRIRVOW-ONUIUJJFSA-N. The full InChI is InChI=1S/C24H23N3O4/c1-17(26-27-24(29)19-10-12-21(30-2)13-11-19)18-8-14-22(15-9-18)31-16-23(28)25-20-6-4-3-5-7-20/h3-15H,16H2,1-2H3,(H,25,28)(H,27,29)/b26-17-.
What are the key properties of N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide?
N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide has a molecular weight of 417.47 g/mol, XLogP of 3.87, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-[4-(2-anilino-2-oxoethoxy)phenyl]ethylideneamino]-4-methoxybenzamide is sourced from PubChem (CID 9359242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).