4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide

C18H20N2O3 — CID 9359348

IUPAC4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide
SMILESCOc1ccc(C/C(C)=N\NC(=O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C18H20N2O3/c1-13(12-14-4-8-16(22-2)9-5-14)19-20-18(21)15-6-10-17(23-3)11-7-15/h4-11H,12H2,1-3H3,(H,20,21)/b19-13-
InChIKeyMDLCLOCWJMBKBH-UYRXBGFRSA-N
MW312.37 g/mol
LogP3.05
Rot. Bonds6

About 4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide

4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide (PubChem CID 9359348) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide
PubChem CID9359348
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide
SMILESCOc1ccc(C/C(C)=N\NC(=O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C18H20N2O3/c1-13(12-14-4-8-16(22-2)9-5-14)19-20-18(21)15-6-10-17(23-3)11-7-15/h4-11H,12H2,1-3H3,(H,20,21)/b19-13-
InChIKeyMDLCLOCWJMBKBH-UYRXBGFRSA-N
XLogP3.05
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

3-iodo-N-[1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide
CID 3923844
methyl (3Z)-3-[(4-methoxybenzoyl)hydrazinylidene]butanoate
CID 23268418
N'-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]oxamide
CID 9120892
2-bromo-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide
CID 7937148
N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]cyclopropanecarboxamide
CID 9234745
N-[(Z)-1-(3,4-dimethoxyphenyl)propan-2-ylideneamino]-4-propan-2-yloxybenzamide
CID 9215818
N'-[1-(4-methoxyphenyl)propan-2-ylideneamino]-N-propan-2-yloxamide
CID 3873637
N-[(Z)-1-(3,4-dimethoxyphenyl)propan-2-ylideneamino]-3,5-dimethoxybenzamide
CID 9461207
N-(butan-2-ylideneamino)-2-(4-methoxyphenyl)acetamide
CID 968760
4-hydroxy-N-[(E)-1-phenylpropan-2-ylideneamino]benzamide
CID 6019614
4-fluoro-N-(1-phenylpropan-2-ylideneamino)benzamide
CID 847534
N-[(Z)-(4-anilino-4-oxobutan-2-ylidene)amino]-4-methoxybenzamide
CID 6382258

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide?
The IUPAC name of 4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide (CID 9359348) is 4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide.
What is the SMILES notation for 4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide?
The canonical SMILES for 4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide is COc1ccc(C/C(C)=N\NC(=O)c2ccc(OC)cc2)cc1.
What is the InChIKey of 4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide?
The InChIKey is MDLCLOCWJMBKBH-UYRXBGFRSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-13(12-14-4-8-16(22-2)9-5-14)19-20-18(21)15-6-10-17(23-3)11-7-15/h4-11H,12H2,1-3H3,(H,20,21)/b19-13-.
What are the key properties of 4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide?
4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide has a molecular weight of 312.37 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(Z)-1-(4-methoxyphenyl)propan-2-ylideneamino]benzamide is sourced from PubChem (CID 9359348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).