[4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine

C11H25N3O — CID 83011706

IUPAC[4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine
SMILESCCC1(C)CC(CN)(NN(C)C)CCO1
InChIInChI=1S/C11H25N3O/c1-5-10(2)8-11(9-12,6-7-15-10)13-14(3)4/h13H,5-9,12H2,1-4H3
InChIKeyWDTANXOLDNWCLF-UHFFFAOYSA-N
MW215.34 g/mol
LogP0.73
Rot. Bonds4

About [4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine

[4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine (PubChem CID 83011706) has the molecular formula C11H25N3O and a molecular weight of 215.34 g/mol. Its IUPAC name is [4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine.

Molecular Properties

Compound Name[4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine
PubChem CID83011706
Molecular FormulaC11H25N3O
Molecular Weight215.34 g/mol
Exact Mass215.20
IUPAC Name[4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine
SMILESCCC1(C)CC(CN)(NN(C)C)CCO1
InChIInChI=1S/C11H25N3O/c1-5-10(2)8-11(9-12,6-7-15-10)13-14(3)4/h13H,5-9,12H2,1-4H3
InChIKeyWDTANXOLDNWCLF-UHFFFAOYSA-N
XLogP0.73
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

CID 151126513
CID 151126513
CID 64103751
CID 64103751
CID 64109525
CID 64109525
CID 64109671
CID 64109671
CID 64109868
CID 64109868
CID 64110071
CID 64110071
CID 64110228
CID 64110228
CID 83003854
CID 83003854
CID 83005215
CID 83005215
CID 83006227
CID 83006227
CID 83007448
CID 83007448
CID 83008949
CID 83008949

Frequently Asked Questions

What is the IUPAC name of [4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine?
The IUPAC name of [4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine (CID 83011706) is [4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine.
What is the SMILES notation for [4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine?
The canonical SMILES for [4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine is CCC1(C)CC(CN)(NN(C)C)CCO1.
What is the InChIKey of [4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine?
The InChIKey is WDTANXOLDNWCLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O/c1-5-10(2)8-11(9-12,6-7-15-10)13-14(3)4/h13H,5-9,12H2,1-4H3.
What are the key properties of [4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine?
[4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine has a molecular weight of 215.34 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,2-dimethylhydrazinyl)-2-ethyl-2-methyloxan-4-yl]methanamine is sourced from PubChem (CID 83011706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).