2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide

C16H15FN2O3 — CID 136653358

IUPAC2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide
SMILESCOc1cc(O)ccc1C=NNC(=O)Cc1ccccc1F
InChIInChI=1S/C16H15FN2O3/c1-22-15-9-13(20)7-6-12(15)10-18-19-16(21)8-11-4-2-3-5-14(11)17/h2-7,9-10,20H,8H2,1H3,(H,19,21)
InChIKeyCGEHDCCFNPRVJW-UHFFFAOYSA-N
MW302.31 g/mol
LogP2.23
Rot. Bonds5

About 2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide

2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide (PubChem CID 136653358) has the molecular formula C16H15FN2O3 and a molecular weight of 302.31 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide
PubChem CID136653358
Molecular FormulaC16H15FN2O3
Molecular Weight302.31 g/mol
Exact Mass302.11
IUPAC Name2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide
SMILESCOc1cc(O)ccc1C=NNC(=O)Cc1ccccc1F
InChIInChI=1S/C16H15FN2O3/c1-22-15-9-13(20)7-6-12(15)10-18-19-16(21)8-11-4-2-3-5-14(11)17/h2-7,9-10,20H,8H2,1H3,(H,19,21)
InChIKeyCGEHDCCFNPRVJW-UHFFFAOYSA-N
XLogP2.23
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.31
LogP ≤ 52.23
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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Related Compounds

N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 136644816
2-(4-hydroxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]acetamide
CID 110515533
4-hydroxy-2-methoxybenzaldehyde;N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]-2-(3-hydroxyphenyl)acetamide;2-(3-hydroxyphenyl)acetohydrazide
CID 158711619
4-chloro-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]benzamide
CID 691020
N-[(E)-(2-fluoro-4-hydroxyphenyl)methylideneamino]-2-(3-hydroxyphenyl)acetamide
CID 135513103
2-(4-bromonaphthalen-1-yl)-N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]acetamide
CID 5457924
N'-[[4-(diethylamino)-2-methoxyphenyl]methylideneamino]-N-(2-fluorophenyl)propanediamide
CID 4026615
3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol
CID 169381641
N-(2-fluorophenyl)-N'-[(2-methoxyphenyl)methylideneamino]butanediamide
CID 3921496
2-(3,4-dimethoxyphenyl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide
CID 137122723
N-[(Z)-(2-fluorophenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 5404184
2-(2-fluorophenoxy)-N-[(E)-(2-hydroxy-3-methoxyphenyl)methylideneamino]acetamide
CID 135852687

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide (CID 136653358) is 2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide is COc1cc(O)ccc1C=NNC(=O)Cc1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide?
The InChIKey is CGEHDCCFNPRVJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O3/c1-22-15-9-13(20)7-6-12(15)10-18-19-16(21)8-11-4-2-3-5-14(11)17/h2-7,9-10,20H,8H2,1H3,(H,19,21).
What are the key properties of 2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide?
2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide has a molecular weight of 302.31 g/mol, XLogP of 2.23, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]acetamide is sourced from PubChem (CID 136653358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).