6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide

C19H27N5O3 — CID 23526916

IUPAC6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide
SMILESCc1ccc(-c2noc(C(CCCC3CCCCC3)CC(=O)NO)n2)nn1
InChIInChI=1S/C19H27N5O3/c1-13-10-11-16(22-21-13)18-20-19(27-24-18)15(12-17(25)23-26)9-5-8-14-6-3-2-4-7-14/h10-11,14-15,26H,2-9,12H2,1H3,(H,23,25)
InChIKeyLXTLKPYLWDWBMH-UHFFFAOYSA-N
MW373.46 g/mol
LogP3.56
Rot. Bonds8

About 6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide

6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide (PubChem CID 23526916) has the molecular formula C19H27N5O3 and a molecular weight of 373.46 g/mol. Its IUPAC name is 6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide.

Molecular Properties

Compound Name6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide
PubChem CID23526916
Molecular FormulaC19H27N5O3
Molecular Weight373.46 g/mol
Exact Mass373.21
IUPAC Name6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide
SMILESCc1ccc(-c2noc(C(CCCC3CCCCC3)CC(=O)NO)n2)nn1
InChIInChI=1S/C19H27N5O3/c1-13-10-11-16(22-21-13)18-20-19(27-24-18)15(12-17(25)23-26)9-5-8-14-6-3-2-4-7-14/h10-11,14-15,26H,2-9,12H2,1H3,(H,23,25)
InChIKeyLXTLKPYLWDWBMH-UHFFFAOYSA-N
XLogP3.56
TPSA114.03 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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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Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide?
The IUPAC name of 6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide (CID 23526916) is 6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide.
What is the SMILES notation for 6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide?
The canonical SMILES for 6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide is Cc1ccc(-c2noc(C(CCCC3CCCCC3)CC(=O)NO)n2)nn1.
What is the InChIKey of 6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide?
The InChIKey is LXTLKPYLWDWBMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O3/c1-13-10-11-16(22-21-13)18-20-19(27-24-18)15(12-17(25)23-26)9-5-8-14-6-3-2-4-7-14/h10-11,14-15,26H,2-9,12H2,1H3,(H,23,25).
What are the key properties of 6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide?
6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide has a molecular weight of 373.46 g/mol, XLogP of 3.56, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-N-hydroxy-3-[3-(6-methylpyridazin-3-yl)-1,2,4-oxadiazol-5-yl]hexanamide is sourced from PubChem (CID 23526916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).