N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide

C21H15ClN2O2 — CID 154037448

IUPACN-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide
SMILESO=C(c1ccccc1)N(N=Cc1ccccc1Cl)C(=O)c1ccccc1
InChIInChI=1S/C21H15ClN2O2/c22-19-14-8-7-13-18(19)15-23-24(20(25)16-9-3-1-4-10-16)21(26)17-11-5-2-6-12-17/h1-15H
InChIKeySUTGQPUGTNGFKE-UHFFFAOYSA-N
MW362.82 g/mol
LogP4.66
Rot. Bonds4

About N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide

N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide (PubChem CID 154037448) has the molecular formula C21H15ClN2O2 and a molecular weight of 362.82 g/mol. Its IUPAC name is N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide.

Molecular Properties

Compound NameN-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide
PubChem CID154037448
Molecular FormulaC21H15ClN2O2
Molecular Weight362.82 g/mol
Exact Mass362.08
IUPAC NameN-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide
SMILESO=C(c1ccccc1)N(N=Cc1ccccc1Cl)C(=O)c1ccccc1
InChIInChI=1S/C21H15ClN2O2/c22-19-14-8-7-13-18(19)15-23-24(20(25)16-9-3-1-4-10-16)21(26)17-11-5-2-6-12-17/h1-15H
InChIKeySUTGQPUGTNGFKE-UHFFFAOYSA-N
XLogP4.66
TPSA49.74 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.82
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide 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

N-[amino-[benzoyl-[(2-chlorophenyl)methylideneamino]amino]methylidene]benzamide
CID 118918800
N-benzoyl-N-(2-chlorophenyl)benzamide
CID 10592933
3-benzyl-1-[(Z)-(2-chlorophenyl)methylideneamino]-1-methylthiourea
CID 9174457
diethyl (Z)-2-[benzoyl-[(E)-(3-chlorophenyl)methylideneamino]amino]but-2-enedioate
CID 46918444
N-tert-butyl-N-[(2-hydroxyphenyl)methylideneamino]benzamide
CID 137119691
(E)-3-(2-chlorophenyl)prop-2-enoic acid
CID 700642
(2,3-dichlorophenyl)methylidenecarbamic acid
CID 68646175
dimethyl (Z)-2-[benzoyl-[(E)-[2-[(Z)-1,4-dimethoxy-1,4-dioxobut-2-en-2-yl]oxyphenyl]methylideneamino]amino]but-2-enedioate
CID 177404478
N-[(Z)-N,N'-bis[(E)-(2-chlorophenyl)methylideneamino]carbamimidoyl]benzamide
CID 135834187
N-[(Z)-(2-chlorophenyl)methylideneamino]-4-(dimethylamino)benzamide
CID 6172930
N-[2-[(2E)-2-[(2-chlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide
CID 43948440
N-(2,6-dichlorophenyl)-N-phenylbenzamide
CID 14251439

Frequently Asked Questions

What is the IUPAC name of N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide?
The IUPAC name of N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide (CID 154037448) is N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide.
What is the SMILES notation for N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide?
The canonical SMILES for N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide is O=C(c1ccccc1)N(N=Cc1ccccc1Cl)C(=O)c1ccccc1.
What is the InChIKey of N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide?
The InChIKey is SUTGQPUGTNGFKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15ClN2O2/c22-19-14-8-7-13-18(19)15-23-24(20(25)16-9-3-1-4-10-16)21(26)17-11-5-2-6-12-17/h1-15H.
What are the key properties of N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide?
N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide has a molecular weight of 362.82 g/mol, XLogP of 4.66, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzoyl-N-[(2-chlorophenyl)methylideneamino]benzamide is sourced from PubChem (CID 154037448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).