2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine

C7H16N2O2 — CID 83015082

IUPAC2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine
SMILESCN(C)NCC1CCOCO1
InChIInChI=1S/C7H16N2O2/c1-9(2)8-5-7-3-4-10-6-11-7/h7-8H,3-6H2,1-2H3
InChIKeyFEXMRLIKFGCOIC-UHFFFAOYSA-N
MW160.22 g/mol
LogP-0.18
Rot. Bonds3

About 2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine

2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine (PubChem CID 83015082) has the molecular formula C7H16N2O2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine.

Molecular Properties

Compound Name2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine
PubChem CID83015082
Molecular FormulaC7H16N2O2
Molecular Weight160.22 g/mol
Exact Mass160.12
IUPAC Name2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine
SMILESCN(C)NCC1CCOCO1
InChIInChI=1S/C7H16N2O2/c1-9(2)8-5-7-3-4-10-6-11-7/h7-8H,3-6H2,1-2H3
InChIKeyFEXMRLIKFGCOIC-UHFFFAOYSA-N
XLogP-0.18
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(1,3-dioxan-4-ylmethyl)propan-2-amine
CID 81100823
1-cyclopropyl-N-(1,3-dioxan-4-ylmethyl)methanamine
CID 81101660
N-(1,3-dioxan-4-ylmethyl)-2,2-dimethylcyclopropan-1-amine
CID 81101804
2-(1,3-dioxan-4-ylmethylamino)-2-methylpropan-1-ol
CID 81102671
N-(1,3-dioxan-4-ylmethyl)-N-methylpropan-2-amine
CID 130677377
N-(1,3-dioxan-4-ylmethyl)-4-methylpiperazin-1-amine
CID 83021019
N-(1,3-dioxan-4-ylmethyl)-2,3-dimethylcyclopentan-1-amine
CID 81102186
N-(1,3-dioxan-4-ylmethyl)-2,2-dimethylbutan-1-amine
CID 103461370
N-(1,3-dioxan-4-ylmethyl)-1-(oxolan-3-yl)methanamine
CID 81102550
4-bromo-N-(1,3-dioxan-4-ylmethyl)aniline
CID 78997204
N-(1,3-dioxan-4-ylmethyl)-1-(2-methylcyclopentyl)methanamine
CID 107418278
(4R)-4-(bromomethyl)-1,3-dioxane
CID 97184612

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine?
The IUPAC name of 2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine (CID 83015082) is 2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine.
What is the SMILES notation for 2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine?
The canonical SMILES for 2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine is CN(C)NCC1CCOCO1.
What is the InChIKey of 2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine?
The InChIKey is FEXMRLIKFGCOIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2/c1-9(2)8-5-7-3-4-10-6-11-7/h7-8H,3-6H2,1-2H3.
What are the key properties of 2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine?
2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine has a molecular weight of 160.22 g/mol, XLogP of -0.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dioxan-4-ylmethyl)-1,1-dimethylhydrazine is sourced from PubChem (CID 83015082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).