2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide

C15H14ClN3O2 — CID 695102

IUPAC2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide
SMILESO=C(CNc1ccccc1Cl)NN=Cc1cccc(O)c1
InChIInChI=1S/C15H14ClN3O2/c16-13-6-1-2-7-14(13)17-10-15(21)19-18-9-11-4-3-5-12(20)8-11/h1-9,17,20H,10H2,(H,19,21)
InChIKeyBFOXCRTWUROTPN-UHFFFAOYSA-N
MW303.75 g/mol
LogP2.61
Rot. Bonds5

About 2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide

2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide (PubChem CID 695102) has the molecular formula C15H14ClN3O2 and a molecular weight of 303.75 g/mol. Its IUPAC name is 2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide
PubChem CID695102
Molecular FormulaC15H14ClN3O2
Molecular Weight303.75 g/mol
Exact Mass303.08
IUPAC Name2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide
SMILESO=C(CNc1ccccc1Cl)NN=Cc1cccc(O)c1
InChIInChI=1S/C15H14ClN3O2/c16-13-6-1-2-7-14(13)17-10-15(21)19-18-9-11-4-3-5-12(20)8-11/h1-9,17,20H,10H2,(H,19,21)
InChIKeyBFOXCRTWUROTPN-UHFFFAOYSA-N
XLogP2.61
TPSA73.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.75
LogP ≤ 52.61
H-Bond Donors ≤ 53
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

2-(2-chloroanilino)-N-[(Z)-(3-chlorophenyl)methylideneamino]acetamide
CID 5427729
N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide
CID 5427716
2-(2-chloroanilino)-N-[(3,5-dibromo-4-hydroxyphenyl)methylideneamino]acetamide
CID 136649492
N-(benzylideneamino)-2-(3-chloro-2-methylanilino)acetamide
CID 968237
2-(2-chloroanilino)-N-[(Z)-(3,5-dichloro-2-hydroxyphenyl)methylideneamino]acetamide
CID 136866501
2-(2-chloroanilino)-N-[(4-cyanophenyl)methylideneamino]acetamide
CID 967968
2-(2-chloroanilino)-N-[(2-methylphenyl)methylideneamino]acetamide
CID 968113
2-chloro-N-[3-[(E)-[[2-(2-methoxyanilino)acetyl]hydrazinylidene]methyl]phenyl]benzamide
CID 42991489
N-[(3,4-dichlorophenyl)methylideneamino]-2-(2-methylanilino)acetamide
CID 4111290
2-(3-chloro-2-methylanilino)-N-[(3,4-dimethoxyphenyl)methylideneamino]acetamide
CID 4629127
N'-[(3-hydroxyphenyl)methylideneamino]-N-(2-methylphenyl)propanediamide
CID 5024067
N-(2-chlorophenyl)-N'-[(4-hydroxyphenyl)methylideneamino]butanediamide
CID 3591287

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide?
The IUPAC name of 2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide (CID 695102) is 2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide.
What is the SMILES notation for 2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide?
The canonical SMILES for 2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide is O=C(CNc1ccccc1Cl)NN=Cc1cccc(O)c1.
What is the InChIKey of 2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide?
The InChIKey is BFOXCRTWUROTPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3O2/c16-13-6-1-2-7-14(13)17-10-15(21)19-18-9-11-4-3-5-12(20)8-11/h1-9,17,20H,10H2,(H,19,21).
What are the key properties of 2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide?
2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide has a molecular weight of 303.75 g/mol, XLogP of 2.61, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide is sourced from PubChem (CID 695102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).