4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide

C19H17N3O2 — CID 70622767

IUPAC4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide
SMILESCc1ccc(C=NNC(=O)c2oc(-c3ccccc3)nc2C)cc1
InChIInChI=1S/C19H17N3O2/c1-13-8-10-15(11-9-13)12-20-22-18(23)17-14(2)21-19(24-17)16-6-4-3-5-7-16/h3-12H,1-2H3,(H,22,23)
InChIKeyIRNTWAXBUGBLFK-UHFFFAOYSA-N
MW319.36 g/mol
LogP3.72
Rot. Bonds4

About 4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide

4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide (PubChem CID 70622767) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is 4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide
PubChem CID70622767
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC Name4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide
SMILESCc1ccc(C=NNC(=O)c2oc(-c3ccccc3)nc2C)cc1
InChIInChI=1S/C19H17N3O2/c1-13-8-10-15(11-9-13)12-20-22-18(23)17-14(2)21-19(24-17)16-6-4-3-5-7-16/h3-12H,1-2H3,(H,22,23)
InChIKeyIRNTWAXBUGBLFK-UHFFFAOYSA-N
XLogP3.72
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 53.72
H-Bond Donors ≤ 51
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 4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide 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-(4-chlorophenyl)-N-[(4-hydroxy-3,5-dimethylphenyl)methylideneamino]-4-methyl-1,3-oxazole-5-carboxamide
CID 136961096
N-(benzylideneamino)-2-phenyl-1,3-oxazole-4-carboxamide
CID 3753779
N-[(E)-benzylideneamino]-2,6-bis(4-methylphenyl)pyridine-4-carboxamide
CID 44721589
2-methyl-N-[(Z)-(4-methylphenyl)methylideneamino]benzamide
CID 5405615
N-[(4-methylphenyl)methylideneamino]-2-pyridin-3-ylquinoline-4-carboxamide
CID 2082865
4-methyl-N-[2-(methylamino)ethyl]-2-phenyl-1,3-oxazole-5-carboxamide;hydrochloride
CID 119504426
N-[(Z)-(4-methoxyphenyl)methylideneamino]-2-(4-methylphenyl)quinoline-4-carboxamide
CID 6000209
2,6-dimethyl-N-[(5-phenylfuran-2-yl)methylideneamino]quinoline-3-carboxamide
CID 1020765
4-methyl-N-(5-methyl-1H-pyrazol-3-yl)-2-phenyl-1,3-oxazole-5-carboxamide
CID 71873822
N-[(Z)-(4-hydroxyphenyl)methylideneamino]-4-phenylbenzamide
CID 136661498
4-[[(2,6-dimethylimidazo[1,2-a]pyridine-3-carbonyl)hydrazinylidene]methyl]benzoic acid
CID 75137265
N-(5-chloro-2-fluorophenyl)-4-methyl-2-phenyl-1,3-oxazole-5-carboxamide
CID 71871784

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide?
The IUPAC name of 4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide (CID 70622767) is 4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for 4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide?
The canonical SMILES for 4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide is Cc1ccc(C=NNC(=O)c2oc(-c3ccccc3)nc2C)cc1.
What is the InChIKey of 4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide?
The InChIKey is IRNTWAXBUGBLFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c1-13-8-10-15(11-9-13)12-20-22-18(23)17-14(2)21-19(24-17)16-6-4-3-5-7-16/h3-12H,1-2H3,(H,22,23).
What are the key properties of 4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide?
4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide has a molecular weight of 319.36 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(4-methylphenyl)methylideneamino]-2-phenyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 70622767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).