N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide

C15H14N2O3 — CID 135643112

IUPACN-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)N/N=C/c2ccc(O)cc2)cc1
InChIInChI=1S/C15H14N2O3/c1-20-14-8-4-12(5-9-14)15(19)17-16-10-11-2-6-13(18)7-3-11/h2-10,18H,1H3,(H,17,19)/b16-10+
InChIKeyYOJDLNXKMKZHNY-MHWRWJLKSA-N
MW270.29 g/mol
LogP2.16
Rot. Bonds4

About N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide

N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide (PubChem CID 135643112) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide
PubChem CID135643112
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC NameN-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)N/N=C/c2ccc(O)cc2)cc1
InChIInChI=1S/C15H14N2O3/c1-20-14-8-4-12(5-9-14)15(19)17-16-10-11-2-6-13(18)7-3-11/h2-10,18H,1H3,(H,17,19)/b16-10+
InChIKeyYOJDLNXKMKZHNY-MHWRWJLKSA-N
XLogP2.16
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide?
The IUPAC name of N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide (CID 135643112) is N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide.
What is the SMILES notation for N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide?
The canonical SMILES for N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide is COc1ccc(C(=O)N/N=C/c2ccc(O)cc2)cc1.
What is the InChIKey of N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide?
The InChIKey is YOJDLNXKMKZHNY-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-20-14-8-4-12(5-9-14)15(19)17-16-10-11-2-6-13(18)7-3-11/h2-10,18H,1H3,(H,17,19)/b16-10+.
What are the key properties of N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide?
N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide has a molecular weight of 270.29 g/mol, XLogP of 2.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-methoxybenzamide is sourced from PubChem (CID 135643112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).