N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide

C17H9Cl2N3O2 — CID 3232312

IUPACN-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ncoc2-c2cccc(Cl)c2)cc1Cl
InChIInChI=1S/C17H9Cl2N3O2/c18-12-3-1-2-10(6-12)16-15(21-9-24-16)17(23)22-13-5-4-11(8-20)14(19)7-13/h1-7,9H,(H,22,23)
InChIKeyCOAOOWCOYOSKHH-UHFFFAOYSA-N
MW358.18 g/mol
LogP4.77
Rot. Bonds3

About N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide

N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide (PubChem CID 3232312) has the molecular formula C17H9Cl2N3O2 and a molecular weight of 358.18 g/mol. Its IUPAC name is N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide
PubChem CID3232312
Molecular FormulaC17H9Cl2N3O2
Molecular Weight358.18 g/mol
Exact Mass357.01
IUPAC NameN-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ncoc2-c2cccc(Cl)c2)cc1Cl
InChIInChI=1S/C17H9Cl2N3O2/c18-12-3-1-2-10(6-12)16-15(21-9-24-16)17(23)22-13-5-4-11(8-20)14(19)7-13/h1-7,9H,(H,22,23)
InChIKeyCOAOOWCOYOSKHH-UHFFFAOYSA-N
XLogP4.77
TPSA78.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.18
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-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

N-(3-chlorophenyl)-5-(3-methoxyphenyl)-1,3-oxazole-4-carboxamide
CID 20963631
N-(3-chloro-4-cyanophenyl)-4-phenylbenzamide
CID 2113579
5-(3-chlorophenyl)-N-(2,5-difluorophenyl)-1,3-oxazole-4-carboxamide
CID 3232315
N-(3-chloro-4-cyanophenyl)-3-hydroxypyridine-2-carboxamide
CID 54861491
N-(3-chlorophenyl)-5-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carboxamide
CID 20963819
5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide
CID 2739761
1-[5-(3-chlorophenyl)-1,3-oxazol-4-yl]ethanone
CID 123160413
5-(3-chlorophenyl)-N-[(2R)-2-phenylpropyl]-1,3-oxazole-4-carboxamide
CID 92711313
5-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-oxazole-4-carboxamide
CID 20963629
methyl 3-[(5-phenyl-1,3-oxazole-4-carbonyl)amino]benzoate
CID 110689290
2-amino-4-chloro-N-(3-chloro-4-cyanophenyl)benzamide
CID 43168358
5-[(3-chloro-4-cyanophenyl)carbamoyl]furan-3-carboxylic acid
CID 104607066

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide (CID 3232312) is N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide is N#Cc1ccc(NC(=O)c2ncoc2-c2cccc(Cl)c2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide?
The InChIKey is COAOOWCOYOSKHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H9Cl2N3O2/c18-12-3-1-2-10(6-12)16-15(21-9-24-16)17(23)22-13-5-4-11(8-20)14(19)7-13/h1-7,9H,(H,22,23).
What are the key properties of N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide?
N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide has a molecular weight of 358.18 g/mol, XLogP of 4.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-cyanophenyl)-5-(3-chlorophenyl)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 3232312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).