[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine

C16H30N2O3 — CID 105325538

IUPAC[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine
SMILESNNC(CCC1CCCCO1)C1CCOC2(CCOC2)C1
InChIInChI=1S/C16H30N2O3/c17-18-15(5-4-14-3-1-2-8-20-14)13-6-9-21-16(11-13)7-10-19-12-16/h13-15,18H,1-12,17H2
InChIKeyHOUBLKLAFFDJKB-UHFFFAOYSA-N
MW298.43 g/mol
LogP1.75
Rot. Bonds5

About [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine

[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine (PubChem CID 105325538) has the molecular formula C16H30N2O3 and a molecular weight of 298.43 g/mol. Its IUPAC name is [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine
PubChem CID105325538
Molecular FormulaC16H30N2O3
Molecular Weight298.43 g/mol
Exact Mass298.23
IUPAC Name[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine
SMILESNNC(CCC1CCCCO1)C1CCOC2(CCOC2)C1
InChIInChI=1S/C16H30N2O3/c17-18-15(5-4-14-3-1-2-8-20-14)13-6-9-21-16(11-13)7-10-19-12-16/h13-15,18H,1-12,17H2
InChIKeyHOUBLKLAFFDJKB-UHFFFAOYSA-N
XLogP1.75
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine?
The IUPAC name of [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine (CID 105325538) is [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine.
What is the SMILES notation for [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine?
The canonical SMILES for [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine is NNC(CCC1CCCCO1)C1CCOC2(CCOC2)C1.
What is the InChIKey of [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine?
The InChIKey is HOUBLKLAFFDJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O3/c17-18-15(5-4-14-3-1-2-8-20-14)13-6-9-21-16(11-13)7-10-19-12-16/h13-15,18H,1-12,17H2.
What are the key properties of [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine?
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine has a molecular weight of 298.43 g/mol, XLogP of 1.75, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-(oxan-2-yl)propyl]hydrazine is sourced from PubChem (CID 105325538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).