N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide

C15H11ClN2O4 — CID 24772600

IUPACN-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide
SMILESCC(=O)N(O)Oc1ccc(-c2nc3cc(Cl)ccc3o2)cc1
InChIInChI=1S/C15H11ClN2O4/c1-9(19)18(20)22-12-5-2-10(3-6-12)15-17-13-8-11(16)4-7-14(13)21-15/h2-8,20H,1H3
InChIKeyIWUCARIIYRDCOU-UHFFFAOYSA-N
MW318.72 g/mol
LogP3.68
Rot. Bonds3

About N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide

N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide (PubChem CID 24772600) has the molecular formula C15H11ClN2O4 and a molecular weight of 318.72 g/mol. Its IUPAC name is N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide.

Molecular Properties

Compound NameN-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide
PubChem CID24772600
Molecular FormulaC15H11ClN2O4
Molecular Weight318.72 g/mol
Exact Mass318.04
IUPAC NameN-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide
SMILESCC(=O)N(O)Oc1ccc(-c2nc3cc(Cl)ccc3o2)cc1
InChIInChI=1S/C15H11ClN2O4/c1-9(19)18(20)22-12-5-2-10(3-6-12)15-17-13-8-11(16)4-7-14(13)21-15/h2-8,20H,1H3
InChIKeyIWUCARIIYRDCOU-UHFFFAOYSA-N
XLogP3.68
TPSA75.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.72
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide 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

5-chloro-2-(4-methylsulfonylphenyl)-1,3-benzoxazole
CID 67331973
5-chloro-2-(3,5-dimethoxyphenyl)-1,3-benzoxazole
CID 839464
N-[4-[5-(4-chlorophenyl)-1,3-benzoxazol-2-yl]phenyl]acetamide
CID 67332633
N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-2-(4-ethylphenoxy)acetamide
CID 46231324
2-(4-chlorophenyl)-1,3-benzoxazole-5-carboxamide
CID 67331843
N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]acetamide
CID 1146260
N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-2-(4-fluorophenoxy)acetamide
CID 46230595
2-(4-chlorophenyl)-N-propan-2-yl-1,3-benzoxazole-5-carboxamide
CID 53237443
2-[4-(bromomethyl)phenyl]-5-chloro-1,3-benzoxazole
CID 14074210
2-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]ethanamine
CID 43665734
4-[(E)-2-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]ethenyl]-N,N-dimethylaniline
CID 25211870
N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-(4-methylphenoxy)acetamide
CID 23847828

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide?
The IUPAC name of N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide (CID 24772600) is N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide.
What is the SMILES notation for N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide?
The canonical SMILES for N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide is CC(=O)N(O)Oc1ccc(-c2nc3cc(Cl)ccc3o2)cc1.
What is the InChIKey of N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide?
The InChIKey is IWUCARIIYRDCOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O4/c1-9(19)18(20)22-12-5-2-10(3-6-12)15-17-13-8-11(16)4-7-14(13)21-15/h2-8,20H,1H3.
What are the key properties of N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide?
N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide has a molecular weight of 318.72 g/mol, XLogP of 3.68, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenoxy]-N-hydroxyacetamide is sourced from PubChem (CID 24772600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).