3-hydroxy-3-methylhexanehydrazide

C7H16N2O2 — CID 59409443

IUPAC3-hydroxy-3-methylhexanehydrazide
SMILESCCCC(C)(O)CC(=O)NN
InChIInChI=1S/C7H16N2O2/c1-3-4-7(2,11)5-6(10)9-8/h11H,3-5,8H2,1-2H3,(H,9,10)
InChIKeyWMQLAVTXPXEHJV-UHFFFAOYSA-N
MW160.22 g/mol
LogP-0.08
Rot. Bonds4

About 3-hydroxy-3-methylhexanehydrazide

3-hydroxy-3-methylhexanehydrazide (PubChem CID 59409443) has the molecular formula C7H16N2O2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 3-hydroxy-3-methylhexanehydrazide.

Molecular Properties

Compound Name3-hydroxy-3-methylhexanehydrazide
PubChem CID59409443
Molecular FormulaC7H16N2O2
Molecular Weight160.22 g/mol
Exact Mass160.12
IUPAC Name3-hydroxy-3-methylhexanehydrazide
SMILESCCCC(C)(O)CC(=O)NN
InChIInChI=1S/C7H16N2O2/c1-3-4-7(2,11)5-6(10)9-8/h11H,3-5,8H2,1-2H3,(H,9,10)
InChIKeyWMQLAVTXPXEHJV-UHFFFAOYSA-N
XLogP-0.08
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 5-0.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3,3,6,6-tetramethyloctanedihydrazide
CID 123887942
5-hydroxy-5-methyloctan-3-one
CID 87431906
3-ethyl-3,5,5-trimethylheptanedihydrazide
CID 118550299
3,3,3-trichloropropanehydrazide
CID 134894748
(2R)-1-amino-2-methylpentan-2-ol
CID 51381277
1,3-bis(2-aminopentan-2-yl)urea
CID 88745593
3-amino-N-(2-hydroxy-2-methylpentyl)-4-methylpentanamide
CID 106292069
3-(hydrazinecarbonyl)-5-hydrazinyl-3-hydroxy-N-methyl-5-oxopentanamide
CID 122496103
N'-amino-4-hydrazinyl-2,2-dimethyl-4-oxobutanimidamide
CID 10035076
propanehydrazide;dihydrochloride
CID 121342206
ethane;propanehydrazide
CID 143310399
2-amino-3,3,3-trifluoro-N-(2-hydroxy-2-methylpentyl)-2-methylpropanamide
CID 114169327

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-3-methylhexanehydrazide?
The IUPAC name of 3-hydroxy-3-methylhexanehydrazide (CID 59409443) is 3-hydroxy-3-methylhexanehydrazide.
What is the SMILES notation for 3-hydroxy-3-methylhexanehydrazide?
The canonical SMILES for 3-hydroxy-3-methylhexanehydrazide is CCCC(C)(O)CC(=O)NN.
What is the InChIKey of 3-hydroxy-3-methylhexanehydrazide?
The InChIKey is WMQLAVTXPXEHJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2/c1-3-4-7(2,11)5-6(10)9-8/h11H,3-5,8H2,1-2H3,(H,9,10).
What are the key properties of 3-hydroxy-3-methylhexanehydrazide?
3-hydroxy-3-methylhexanehydrazide has a molecular weight of 160.22 g/mol, XLogP of -0.08, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-3-methylhexanehydrazide is sourced from PubChem (CID 59409443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).