O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine

C8H16N2O2 — CID 130963877

IUPACO-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine
SMILESNOCCN1CC2CCC(C1)O2
InChIInChI=1S/C8H16N2O2/c9-11-4-3-10-5-7-1-2-8(6-10)12-7/h7-8H,1-6,9H2
InChIKeyFILDSPUXYBLQJI-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.26
Rot. Bonds3

About O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine

O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine (PubChem CID 130963877) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine.

Molecular Properties

Compound NameO-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine
PubChem CID130963877
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC NameO-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine
SMILESNOCCN1CC2CCC(C1)O2
InChIInChI=1S/C8H16N2O2/c9-11-4-3-10-5-7-1-2-8(6-10)12-7/h7-8H,1-6,9H2
InChIKeyFILDSPUXYBLQJI-UHFFFAOYSA-N
XLogP-0.26
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.26
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

2-methyl-4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)butan-1-amine
CID 81079462
hydrazinyl 3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propanoate
CID 66371826
3-(3,3-diethoxypropyl)-8-oxa-3-azabicyclo[3.2.1]octane
CID 66391359
4-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethoxy]naphthalen-1-amine
CID 69254163
6-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)hexan-1-ol
CID 103738015
N-(2-methoxyethyl)-4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)butan-1-amine
CID 66371612
5-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentanoic acid
CID 66391546
N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclopentanamine
CID 66369856
5-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentanehydrazide
CID 66371828
2-amino-2-methyl-4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)butanenitrile
CID 66370572
N-ethyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propan-1-amine
CID 66393443
1-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]pyrazol-4-amine
CID 66392642

Frequently Asked Questions

What is the IUPAC name of O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine?
The IUPAC name of O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine (CID 130963877) is O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine.
What is the SMILES notation for O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine?
The canonical SMILES for O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine is NOCCN1CC2CCC(C1)O2.
What is the InChIKey of O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine?
The InChIKey is FILDSPUXYBLQJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c9-11-4-3-10-5-7-1-2-8(6-10)12-7/h7-8H,1-6,9H2.
What are the key properties of O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine?
O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine has a molecular weight of 172.23 g/mol, XLogP of -0.26, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]hydroxylamine is sourced from PubChem (CID 130963877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).