2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide

C15H15N3O2 — CID 135684822

IUPAC2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide
SMILESO=C(CNc1ccccc1)N/N=C/c1ccccc1O
InChIInChI=1S/C15H15N3O2/c19-14-9-5-4-6-12(14)10-17-18-15(20)11-16-13-7-2-1-3-8-13/h1-10,16,19H,11H2,(H,18,20)/b17-10+
InChIKeyMJUMZJXENXJDKV-LICLKQGHSA-N
MW269.30 g/mol
LogP1.95
Rot. Bonds5

About 2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide

2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide (PubChem CID 135684822) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide
PubChem CID135684822
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide
SMILESO=C(CNc1ccccc1)N/N=C/c1ccccc1O
InChIInChI=1S/C15H15N3O2/c19-14-9-5-4-6-12(14)10-17-18-15(20)11-16-13-7-2-1-3-8-13/h1-10,16,19H,11H2,(H,18,20)/b17-10+
InChIKeyMJUMZJXENXJDKV-LICLKQGHSA-N
XLogP1.95
TPSA73.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', '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 2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide?
The IUPAC name of 2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide (CID 135684822) is 2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide.
What is the SMILES notation for 2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide?
The canonical SMILES for 2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide is O=C(CNc1ccccc1)N/N=C/c1ccccc1O.
What is the InChIKey of 2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide?
The InChIKey is MJUMZJXENXJDKV-LICLKQGHSA-N. The full InChI is InChI=1S/C15H15N3O2/c19-14-9-5-4-6-12(14)10-17-18-15(20)11-16-13-7-2-1-3-8-13/h1-10,16,19H,11H2,(H,18,20)/b17-10+.
What are the key properties of 2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide?
2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide has a molecular weight of 269.30 g/mol, XLogP of 1.95, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide is sourced from PubChem (CID 135684822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).