N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide

C19H17N3O4 — CID 142446438

IUPACN-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide
SMILESO=C(NCCc1cc(C(=O)NO)no1)c1cccc(-c2ccccc2)c1
InChIInChI=1S/C19H17N3O4/c23-18(20-10-9-16-12-17(22-26-16)19(24)21-25)15-8-4-7-14(11-15)13-5-2-1-3-6-13/h1-8,11-12,25H,9-10H2,(H,20,23)(H,21,24)
InChIKeyWJTIJZGSCAJHKB-UHFFFAOYSA-N
MW351.36 g/mol
LogP2.43
Rot. Bonds6

About N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide

N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide (PubChem CID 142446438) has the molecular formula C19H17N3O4 and a molecular weight of 351.36 g/mol. Its IUPAC name is N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide
PubChem CID142446438
Molecular FormulaC19H17N3O4
Molecular Weight351.36 g/mol
Exact Mass351.12
IUPAC NameN-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide
SMILESO=C(NCCc1cc(C(=O)NO)no1)c1cccc(-c2ccccc2)c1
InChIInChI=1S/C19H17N3O4/c23-18(20-10-9-16-12-17(22-26-16)19(24)21-25)15-8-4-7-14(11-15)13-5-2-1-3-6-13/h1-8,11-12,25H,9-10H2,(H,20,23)(H,21,24)
InChIKeyWJTIJZGSCAJHKB-UHFFFAOYSA-N
XLogP2.43
TPSA104.46 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.36
LogP ≤ 52.43
H-Bond Donors ≤ 53
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'}

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Related Compounds

N-cyclopentyl-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
CID 1093781
Tert-butyl 3-(3-((7-(hydroxyamino)-7-oxoheptyl)carbamoyl)isoxazol-5-yl)phenylcarbamate
CID 24951312
5-benzyl-N-[(3S)-5-methyl-4-oxo-2,3-dihydro-1H-1,5-benzodiazepin-3-yl]-1,2-oxazole-3-carboxamide
CID 118557322
Azepan-1-yl-(5-phenyl-isoxazol-3-yl)-methanone
CID 1093742
N-cyclohexyl-5-(4-methylphenyl)-3-isoxazolecarboxamide
CID 1093785
5-(2-chlorophenyl)-N-cyclohexyl-3-isoxazolecarboxamide
CID 1093865
N-cyclopentyl-5-(4-fluorophenyl)isoxazole-3-carboxamide
CID 17252686
N-(4-ethylphenyl)-5-propyl-3-isoxazolecarboxamide
CID 17253304
5-Phenylisoxazol-3-yl 4-phenylpiperazinyl ketone
CID 1250455
N-[3-(4-morpholinyl)propyl]-5-phenyl-3-isoxazolecarboxamide
CID 2217157
3-Isoxazolecarboxamide, 5-methyl-N-(2-(phenylmethyl)phenyl)-
CID 1246614
N-[(2S)-3-(4-fluorophenyl)-1-oxo-1-[[(2S)-1-oxo-3-[(3S)-2-oxopiperidin-3-yl]propan-2-yl]amino]propan-2-yl]-5-methyl-1,2-oxazole-3-carboxamide
CID 127040522

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide (CID 142446438) is N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide is O=C(NCCc1cc(C(=O)NO)no1)c1cccc(-c2ccccc2)c1.
What is the InChIKey of N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide?
The InChIKey is WJTIJZGSCAJHKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O4/c23-18(20-10-9-16-12-17(22-26-16)19(24)21-25)15-8-4-7-14(11-15)13-5-2-1-3-6-13/h1-8,11-12,25H,9-10H2,(H,20,23)(H,21,24).
What are the key properties of N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide?
N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide has a molecular weight of 351.36 g/mol, XLogP of 2.43, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-5-[2-[(3-phenylbenzoyl)amino]ethyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 142446438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).