N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide

C16H17ClN2O2 — CID 112503058

IUPACN-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide
SMILESO=C(Nc1cc(-c2ccc(Cl)cc2)no1)C1CCCCC1
InChIInChI=1S/C16H17ClN2O2/c17-13-8-6-11(7-9-13)14-10-15(21-19-14)18-16(20)12-4-2-1-3-5-12/h6-10,12H,1-5H2,(H,18,20)
InChIKeyPOSQSJFYLWSSAZ-UHFFFAOYSA-N
MW304.78 g/mol
LogP4.51
Rot. Bonds3

About N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide

N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide (PubChem CID 112503058) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide
PubChem CID112503058
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC NameN-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide
SMILESO=C(Nc1cc(-c2ccc(Cl)cc2)no1)C1CCCCC1
InChIInChI=1S/C16H17ClN2O2/c17-13-8-6-11(7-9-13)14-10-15(21-19-14)18-16(20)12-4-2-1-3-5-12/h6-10,12H,1-5H2,(H,18,20)
InChIKeyPOSQSJFYLWSSAZ-UHFFFAOYSA-N
XLogP4.51
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide 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

1-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]-3-cyclohexylurea
CID 112503079
(3S)-N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 35042577
N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]cyclopentanecarboxamide
CID 99635970
(3R)-1-acetyl-N-[3-(2,3-dihydro-1H-inden-5-yl)-1,2-oxazol-5-yl]pyrrolidine-3-carboxamide
CID 97221496
N-(4-chloro-2-iodophenyl)cyclooctanecarboxamide
CID 107640629
N-(2-bromo-5-chlorophenyl)cyclohexanecarboxamide
CID 81272184
1-[6-(4-chlorophenyl)pyridazin-3-yl]-N-(5-methyl-1,2-oxazol-3-yl)piperidine-3-carboxamide
CID 52992502
N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]-6-oxo-1H-pyridine-3-carboxamide
CID 110621439
N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)acetamide
CID 110621435
1-[(3-chlorophenyl)methyl]-3-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]urea
CID 110302343
N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]-4-(4-methylphenyl)-4-oxobutanamide
CID 110302314
N-[1-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]cyclopentanecarboxamide
CID 83280920

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide?
The IUPAC name of N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide (CID 112503058) is N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide is O=C(Nc1cc(-c2ccc(Cl)cc2)no1)C1CCCCC1.
What is the InChIKey of N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide?
The InChIKey is POSQSJFYLWSSAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c17-13-8-6-11(7-9-13)14-10-15(21-19-14)18-16(20)12-4-2-1-3-5-12/h6-10,12H,1-5H2,(H,18,20).
What are the key properties of N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide?
N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide has a molecular weight of 304.78 g/mol, XLogP of 4.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]cyclohexanecarboxamide is sourced from PubChem (CID 112503058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).