N-(2,2-dimethyloxan-4-yl)hydroxylamine

C7H15NO2 — CID 82684595

IUPACN-(2,2-dimethyloxan-4-yl)hydroxylamine
SMILESCC1(C)CC(NO)CCO1
InChIInChI=1S/C7H15NO2/c1-7(2)5-6(8-9)3-4-10-7/h6,8-9H,3-5H2,1-2H3
InChIKeyDWXXVWGHAYFGQH-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.92
Rot. Bonds1

About N-(2,2-dimethyloxan-4-yl)hydroxylamine

N-(2,2-dimethyloxan-4-yl)hydroxylamine (PubChem CID 82684595) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is N-(2,2-dimethyloxan-4-yl)hydroxylamine.

Molecular Properties

Compound NameN-(2,2-dimethyloxan-4-yl)hydroxylamine
PubChem CID82684595
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC NameN-(2,2-dimethyloxan-4-yl)hydroxylamine
SMILESCC1(C)CC(NO)CCO1
InChIInChI=1S/C7H15NO2/c1-7(2)5-6(8-9)3-4-10-7/h6,8-9H,3-5H2,1-2H3
InChIKeyDWXXVWGHAYFGQH-UHFFFAOYSA-N
XLogP0.92
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyloxan-4-yl)hydroxylamine?
The IUPAC name of N-(2,2-dimethyloxan-4-yl)hydroxylamine (CID 82684595) is N-(2,2-dimethyloxan-4-yl)hydroxylamine.
What is the SMILES notation for N-(2,2-dimethyloxan-4-yl)hydroxylamine?
The canonical SMILES for N-(2,2-dimethyloxan-4-yl)hydroxylamine is CC1(C)CC(NO)CCO1.
What is the InChIKey of N-(2,2-dimethyloxan-4-yl)hydroxylamine?
The InChIKey is DWXXVWGHAYFGQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-7(2)5-6(8-9)3-4-10-7/h6,8-9H,3-5H2,1-2H3.
What are the key properties of N-(2,2-dimethyloxan-4-yl)hydroxylamine?
N-(2,2-dimethyloxan-4-yl)hydroxylamine has a molecular weight of 145.20 g/mol, XLogP of 0.92, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyloxan-4-yl)hydroxylamine is sourced from PubChem (CID 82684595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).