[3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine

C13H28N2O2 — CID 105272334

IUPAC[3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine
SMILESCCOC(C(C)C)C(CC1CCOCC1)NN
InChIInChI=1S/C13H28N2O2/c1-4-17-13(10(2)3)12(15-14)9-11-5-7-16-8-6-11/h10-13,15H,4-9,14H2,1-3H3
InChIKeyKMJAXJARNSONQN-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.70
Rot. Bonds7

About [3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine

[3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine (PubChem CID 105272334) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is [3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine.

Molecular Properties

Compound Name[3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine
PubChem CID105272334
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name[3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine
SMILESCCOC(C(C)C)C(CC1CCOCC1)NN
InChIInChI=1S/C13H28N2O2/c1-4-17-13(10(2)3)12(15-14)9-11-5-7-16-8-6-11/h10-13,15H,4-9,14H2,1-3H3
InChIKeyKMJAXJARNSONQN-UHFFFAOYSA-N
XLogP1.70
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[3-ethoxy-1-(oxan-4-yl)pentan-2-yl]hydrazine
CID 105270961
[3,4-dimethyl-1-(oxan-4-yl)pentan-2-yl]hydrazine
CID 105298895
(3-ethoxy-2,6-dimethyloctan-4-yl)hydrazine
CID 105272508
3-ethoxy-1-(oxan-4-yl)pentan-2-amine
CID 116716257
(1-cyclopentyl-3-methylpentan-2-yl)hydrazine
CID 105219565
3-methyl-1-(oxan-4-yl)pentan-2-amine
CID 63716846
3-methoxy-N-methyl-1-(oxan-4-yl)butan-2-amine
CID 79617524
(1-cyclohexyl-3-cyclopentyl-1-ethoxypropan-2-yl)hydrazine
CID 105278814
[5-methyl-1-(oxan-4-yl)hexan-2-yl]hydrazine
CID 105207471
[4-methoxy-1-(oxan-4-yl)pentan-2-yl]hydrazine
CID 105266970
(2S)-1-(oxan-4-yl)propan-2-amine
CID 94422387
1-(oxan-4-yl)propan-2-amine
CID 21054632

Frequently Asked Questions

What is the IUPAC name of [3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine?
The IUPAC name of [3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine (CID 105272334) is [3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine.
What is the SMILES notation for [3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine?
The canonical SMILES for [3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine is CCOC(C(C)C)C(CC1CCOCC1)NN.
What is the InChIKey of [3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine?
The InChIKey is KMJAXJARNSONQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-4-17-13(10(2)3)12(15-14)9-11-5-7-16-8-6-11/h10-13,15H,4-9,14H2,1-3H3.
What are the key properties of [3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine?
[3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine has a molecular weight of 244.38 g/mol, XLogP of 1.70, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine is sourced from PubChem (CID 105272334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).