N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide

C16H20N2O3 — CID 11616233

IUPACN-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide
SMILESCc1oc(CCCCCC(=O)NO)nc1-c1ccccc1
InChIInChI=1S/C16H20N2O3/c1-12-16(13-8-4-2-5-9-13)17-15(21-12)11-7-3-6-10-14(19)18-20/h2,4-5,8-9,20H,3,6-7,10-11H2,1H3,(H,18,19)
InChIKeyKQNSYUZKBWYADR-UHFFFAOYSA-N
MW288.35 g/mol
LogP3.26
Rot. Bonds7

About N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide

N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide (PubChem CID 11616233) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide.

Molecular Properties

Compound NameN-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide
PubChem CID11616233
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC NameN-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide
SMILESCc1oc(CCCCCC(=O)NO)nc1-c1ccccc1
InChIInChI=1S/C16H20N2O3/c1-12-16(13-8-4-2-5-9-13)17-15(21-12)11-7-3-6-10-14(19)18-20/h2,4-5,8-9,20H,3,6-7,10-11H2,1H3,(H,18,19)
InChIKeyKQNSYUZKBWYADR-UHFFFAOYSA-N
XLogP3.26
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide?
The IUPAC name of N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide (CID 11616233) is N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide.
What is the SMILES notation for N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide?
The canonical SMILES for N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide is Cc1oc(CCCCCC(=O)NO)nc1-c1ccccc1.
What is the InChIKey of N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide?
The InChIKey is KQNSYUZKBWYADR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-12-16(13-8-4-2-5-9-13)17-15(21-12)11-7-3-6-10-14(19)18-20/h2,4-5,8-9,20H,3,6-7,10-11H2,1H3,(H,18,19).
What are the key properties of N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide?
N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide has a molecular weight of 288.35 g/mol, XLogP of 3.26, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-6-(5-methyl-4-phenyl-1,3-oxazol-2-yl)hexanamide is sourced from PubChem (CID 11616233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).