4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide

C11H24N2O3 — CID 112590279

IUPAC4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide
SMILESCC(CCC(=O)NN)OCCOC(C)(C)C
InChIInChI=1S/C11H24N2O3/c1-9(5-6-10(14)13-12)15-7-8-16-11(2,3)4/h9H,5-8,12H2,1-4H3,(H,13,14)
InChIKeyAXQUPLRDSZCYIA-UHFFFAOYSA-N
MW232.32 g/mol
LogP0.98
Rot. Bonds7

About 4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide

4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide (PubChem CID 112590279) has the molecular formula C11H24N2O3 and a molecular weight of 232.32 g/mol. Its IUPAC name is 4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide.

Molecular Properties

Compound Name4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide
PubChem CID112590279
Molecular FormulaC11H24N2O3
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide
SMILESCC(CCC(=O)NN)OCCOC(C)(C)C
InChIInChI=1S/C11H24N2O3/c1-9(5-6-10(14)13-12)15-7-8-16-11(2,3)4/h9H,5-8,12H2,1-4H3,(H,13,14)
InChIKeyAXQUPLRDSZCYIA-UHFFFAOYSA-N
XLogP0.98
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(2-methylpropan-2-yl)oxy]ethyl 4-aminopentanoate
CID 112588145
ethyl 2-amino-2-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanoate
CID 112589158
2,2-dimethyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentane
CID 162034273
(2S)-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]butan-2-ol
CID 103939578
2-[4-(3-amino-3-methylbutoxy)pentanoylamino]-3-methylbutanamide
CID 170100793
2-(ethylamino)-2-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanoic acid
CID 112589153
2-methyl-N-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propyl]propan-2-amine
CID 112589746
3-[1-[(2-methylpropan-2-yl)oxy]propan-2-yloxy]propanoic acid
CID 87458955
N-ethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-amine
CID 112590002
2-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]phenyl]acetohydrazide
CID 105351577
4-(2-methoxyethoxy)pentanoic acid
CID 62215225
dimethyl 2-[2-[(2-methylpropan-2-yl)oxy]ethyl]propanedioate
CID 103972473

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide?
The IUPAC name of 4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide (CID 112590279) is 4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide.
What is the SMILES notation for 4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide?
The canonical SMILES for 4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide is CC(CCC(=O)NN)OCCOC(C)(C)C.
What is the InChIKey of 4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide?
The InChIKey is AXQUPLRDSZCYIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3/c1-9(5-6-10(14)13-12)15-7-8-16-11(2,3)4/h9H,5-8,12H2,1-4H3,(H,13,14).
What are the key properties of 4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide?
4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide has a molecular weight of 232.32 g/mol, XLogP of 0.98, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanehydrazide is sourced from PubChem (CID 112590279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).