2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide

C14H15N3O2 — CID 3871183

IUPAC2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide
SMILESNc1ccc(-c2nc(C(=O)NC3CCC3)co2)cc1
InChIInChI=1S/C14H15N3O2/c15-10-6-4-9(5-7-10)14-17-12(8-19-14)13(18)16-11-2-1-3-11/h4-8,11H,1-3,15H2,(H,16,18)
InChIKeyWGLZCJWNNOAHOL-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.21
Rot. Bonds3

About 2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide

2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide (PubChem CID 3871183) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide
PubChem CID3871183
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide
SMILESNc1ccc(-c2nc(C(=O)NC3CCC3)co2)cc1
InChIInChI=1S/C14H15N3O2/c15-10-6-4-9(5-7-10)14-17-12(8-19-14)13(18)16-11-2-1-3-11/h4-8,11H,1-3,15H2,(H,16,18)
InChIKeyWGLZCJWNNOAHOL-UHFFFAOYSA-N
XLogP2.21
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-cyclododecyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazole-4-carboxamide
CID 84557279
N-(3-aminocyclohexyl)-2-phenyl-1,3-oxazole-4-carboxamide
CID 155298542
2-phenyl-N-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 119390406
2-amino-N-cyclohexyl-1,3-oxazole-4-carboxamide
CID 110848950
2-(4-aminophenyl)-N-pentan-3-yl-1,3-oxazole-4-carboxamide
CID 3872955
2-(4-aminophenyl)-N-hexadecyl-1,3-oxazole-4-carboxamide
CID 3847962
2-(4-aminophenyl)-N-(4-chlorophenyl)-1,3-oxazole-4-carboxamide
CID 3857565
2-(2-aminoethyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide
CID 3254419
2-(4-aminophenyl)-N-benzhydryl-1,3-oxazole-4-carboxamide
CID 3835810
N-(1-imidazo[1,2-a]pyrazin-8-ylpyrrolidin-3-yl)-2-phenyl-1,3-oxazole-4-carboxamide
CID 75202956
2-cyclobutyl-N-[4-[(2-cyclobutyl-1,3-oxazole-4-carbonyl)amino]cyclohexyl]-1,3-oxazole-4-carboxamide
CID 167759305
2-(4-aminophenyl)-N-(4-morpholin-4-ylphenyl)-1,3-oxazole-4-carboxamide
CID 3854955

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide (CID 3871183) is 2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide is Nc1ccc(-c2nc(C(=O)NC3CCC3)co2)cc1.
What is the InChIKey of 2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide?
The InChIKey is WGLZCJWNNOAHOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c15-10-6-4-9(5-7-10)14-17-12(8-19-14)13(18)16-11-2-1-3-11/h4-8,11H,1-3,15H2,(H,16,18).
What are the key properties of 2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide?
2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 3871183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).