[4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine

C13H28N2O2 — CID 103026972

IUPAC[4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine
SMILESCOC(C)(C)CCC(NN)C1(C)CCCCO1
InChIInChI=1S/C13H28N2O2/c1-12(2,16-4)9-7-11(15-14)13(3)8-5-6-10-17-13/h11,15H,5-10,14H2,1-4H3
InChIKeyCSYIDOYJITWHRR-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.98
Rot. Bonds6

About [4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine

[4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine (PubChem CID 103026972) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is [4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine.

Molecular Properties

Compound Name[4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine
PubChem CID103026972
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name[4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine
SMILESCOC(C)(C)CCC(NN)C1(C)CCCCO1
InChIInChI=1S/C13H28N2O2/c1-12(2,16-4)9-7-11(15-14)13(3)8-5-6-10-17-13/h11,15H,5-10,14H2,1-4H3
InChIKeyCSYIDOYJITWHRR-UHFFFAOYSA-N
XLogP1.98
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.98
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

[4-Methoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine
CID 103025265
[3-Methoxy-3-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)butyl]hydrazine
CID 103025401
[1-(1,9-Dioxaspiro[5.5]undecan-4-yl)-3-methoxy-3-methylbutyl]hydrazine
CID 103025410
[3-Methoxy-3-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)butyl]hydrazine
CID 103025520
(1-Ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine
CID 103026298
[4-Methoxy-4-methyl-1-(3-methyloxolan-2-yl)pentyl]hydrazine
CID 103026313
[4-Methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine
CID 103026315
(1,5-Dimethoxy-5-methylhexan-2-yl)hydrazine
CID 103026325
(5-Methoxy-5-methyl-1-propoxyhexan-2-yl)hydrazine
CID 103026700
[4-Methoxy-1-(1-methoxycyclopentyl)-4-methylpentyl]hydrazine
CID 103027058
(3-Ethoxy-7-methoxy-2,7-dimethyloctan-4-yl)hydrazine
CID 103027085
(3-Ethoxy-7-methoxy-2,2,7-trimethyloctan-4-yl)hydrazine
CID 103027096

Frequently Asked Questions

What is the IUPAC name of [4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine?
The IUPAC name of [4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine (CID 103026972) is [4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine.
What is the SMILES notation for [4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine?
The canonical SMILES for [4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine is COC(C)(C)CCC(NN)C1(C)CCCCO1.
What is the InChIKey of [4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine?
The InChIKey is CSYIDOYJITWHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-12(2,16-4)9-7-11(15-14)13(3)8-5-6-10-17-13/h11,15H,5-10,14H2,1-4H3.
What are the key properties of [4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine?
[4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine has a molecular weight of 244.38 g/mol, XLogP of 1.98, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentyl]hydrazine is sourced from PubChem (CID 103026972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).