2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide

C21H20N4O — CID 7601999

IUPAC2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide
SMILESO=C(CNc1ccccc1)N/N=C\c1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C21H20N4O/c26-21(16-22-18-7-3-1-4-8-18)25-23-15-17-11-13-20(14-12-17)24-19-9-5-2-6-10-19/h1-15,22,24H,16H2,(H,25,26)/b23-15-
InChIKeyYGXGWQLCPNIUOC-HAHDFKILSA-N
MW344.42 g/mol
LogP3.99
Rot. Bonds7

About 2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide

2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide (PubChem CID 7601999) has the molecular formula C21H20N4O and a molecular weight of 344.42 g/mol. Its IUPAC name is 2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide
PubChem CID7601999
Molecular FormulaC21H20N4O
Molecular Weight344.42 g/mol
Exact Mass344.16
IUPAC Name2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide
SMILESO=C(CNc1ccccc1)N/N=C\c1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C21H20N4O/c26-21(16-22-18-7-3-1-4-8-18)25-23-15-17-11-13-20(14-12-17)24-19-9-5-2-6-10-19/h1-15,22,24H,16H2,(H,25,26)/b23-15-
InChIKeyYGXGWQLCPNIUOC-HAHDFKILSA-N
XLogP3.99
TPSA65.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 53.99
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'}

Analyze 2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-anilino-N-[(Z)-(4-propan-2-ylphenyl)methylideneamino]acetamide
CID 7784431
N-(benzylideneamino)-2-(4-methylanilino)acetamide
CID 689462
2-(4-chloroanilino)-N-[(4-chlorophenyl)methylideneamino]acetamide
CID 690289
2-anilino-N-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]acetamide
CID 6904248
2-anilino-N-[(Z)-(4-hydroxy-3-methoxyphenyl)methylideneamino]acetamide
CID 136867320
2-anilino-N-[(E)-(4-hydroxy-3-methoxyphenyl)methylideneamino]acetamide
CID 135679320
[4-[(Z)-[(2-anilinoacetyl)hydrazinylidene]methyl]phenyl] 4-bromobenzoate
CID 5443063
2-anilino-N-[(Z)-(2-methylphenyl)methylideneamino]acetamide
CID 7638625
2-anilino-N-[(E)-1H-pyrrol-2-ylmethylideneamino]acetamide
CID 135641150
2-anilino-N-[(4-chloro-3-nitrophenyl)methylideneamino]acetamide
CID 679045
2-anilino-N-(furan-2-ylmethylideneamino)acetamide
CID 3757182
N-[(4-chlorophenyl)methylideneamino]-2-(4-methylanilino)acetamide
CID 689465

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide?
The IUPAC name of 2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide (CID 7601999) is 2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide.
What is the SMILES notation for 2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide?
The canonical SMILES for 2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide is O=C(CNc1ccccc1)N/N=C\c1ccc(Nc2ccccc2)cc1.
What is the InChIKey of 2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide?
The InChIKey is YGXGWQLCPNIUOC-HAHDFKILSA-N. The full InChI is InChI=1S/C21H20N4O/c26-21(16-22-18-7-3-1-4-8-18)25-23-15-17-11-13-20(14-12-17)24-19-9-5-2-6-10-19/h1-15,22,24H,16H2,(H,25,26)/b23-15-.
What are the key properties of 2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide?
2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide has a molecular weight of 344.42 g/mol, XLogP of 3.99, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-[(Z)-(4-anilinophenyl)methylideneamino]acetamide is sourced from PubChem (CID 7601999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).