N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide

C18H23N3O5S — CID 57403166

IUPACN-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide
SMILESO=C(CCCC1CCN(S(=O)(=O)c2ccc(-c3cnco3)cc2)CC1)NO
InChIInChI=1S/C18H23N3O5S/c22-18(20-23)3-1-2-14-8-10-21(11-9-14)27(24,25)16-6-4-15(5-7-16)17-12-19-13-26-17/h4-7,12-14,23H,1-3,8-11H2,(H,20,22)
InChIKeyWGISCGSLSUFHGP-UHFFFAOYSA-N
MW393.47 g/mol
LogP2.42
Rot. Bonds7

About N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide

N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide (PubChem CID 57403166) has the molecular formula C18H23N3O5S and a molecular weight of 393.47 g/mol. Its IUPAC name is N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide.

Molecular Properties

Compound NameN-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide
PubChem CID57403166
Molecular FormulaC18H23N3O5S
Molecular Weight393.47 g/mol
Exact Mass393.14
IUPAC NameN-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide
SMILESO=C(CCCC1CCN(S(=O)(=O)c2ccc(-c3cnco3)cc2)CC1)NO
InChIInChI=1S/C18H23N3O5S/c22-18(20-23)3-1-2-14-8-10-21(11-9-14)27(24,25)16-6-4-15(5-7-16)17-12-19-13-26-17/h4-7,12-14,23H,1-3,8-11H2,(H,20,22)
InChIKeyWGISCGSLSUFHGP-UHFFFAOYSA-N
XLogP2.42
TPSA112.74 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.47
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-hydroxy-4-[1-[4-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]butanamide
CID 57390847
N-hydroxy-4-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)butanamide
CID 11848948
4-(hydroxymethyl)-1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylazepan-4-ol
CID 56904142
N-[[1-[5-(1,3-oxazol-5-yl)thiophen-2-yl]sulfonylpiperidin-4-yl]methyl]prop-2-enamide
CID 89236667
1-naphthalen-2-ylsulfonyl-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-4-carboxamide
CID 55834624
4-(4-propylpiperidin-1-yl)sulfonylbenzoic acid
CID 62206118
N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide
CID 52918058
1-(3-chloro-4-fluorophenyl)sulfonyl-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-4-carboxamide
CID 55834748
N,N'-bis[4-(4-methylpiperidin-1-yl)sulfonylphenyl]hexanediamide
CID 5172520
methyl 4-[[4-(1,3-oxazol-5-yl)phenyl]sulfonylamino]cyclohexane-1-carboxylate
CID 58291840
1-(4-methylphenyl)sulfonyl-4-(3-piperidin-4-ylpropyl)piperidine
CID 70037679
N-[4-(4-benzylpiperidin-1-yl)sulfonylphenyl]-4-(1,3-dioxoisoindol-2-yl)butanamide
CID 3342078

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide?
The IUPAC name of N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide (CID 57403166) is N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide.
What is the SMILES notation for N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide?
The canonical SMILES for N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide is O=C(CCCC1CCN(S(=O)(=O)c2ccc(-c3cnco3)cc2)CC1)NO.
What is the InChIKey of N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide?
The InChIKey is WGISCGSLSUFHGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O5S/c22-18(20-23)3-1-2-14-8-10-21(11-9-14)27(24,25)16-6-4-15(5-7-16)17-12-19-13-26-17/h4-7,12-14,23H,1-3,8-11H2,(H,20,22).
What are the key properties of N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide?
N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide has a molecular weight of 393.47 g/mol, XLogP of 2.42, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[1-[4-(1,3-oxazol-5-yl)phenyl]sulfonylpiperidin-4-yl]butanamide is sourced from PubChem (CID 57403166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).