1-oxa-3,9-diazaspiro[4.6]undecane

C8H16N2O — CID 138582776

IUPAC1-oxa-3,9-diazaspiro[4.6]undecane
SMILESC1CNCCC2(C1)CNCO2
InChIInChI=1S/C8H16N2O/c1-2-8(3-5-9-4-1)6-10-7-11-8/h9-10H,1-7H2
InChIKeyQHRYENYECUXFQY-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.08
Rot. Bonds

About 1-oxa-3,9-diazaspiro[4.6]undecane

1-oxa-3,9-diazaspiro[4.6]undecane (PubChem CID 138582776) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 1-oxa-3,9-diazaspiro[4.6]undecane.

Molecular Properties

Compound Name1-oxa-3,9-diazaspiro[4.6]undecane
PubChem CID138582776
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name1-oxa-3,9-diazaspiro[4.6]undecane
SMILESC1CNCCC2(C1)CNCO2
InChIInChI=1S/C8H16N2O/c1-2-8(3-5-9-4-1)6-10-7-11-8/h9-10H,1-7H2
InChIKeyQHRYENYECUXFQY-UHFFFAOYSA-N
XLogP0.08
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-oxa-3,9-diazaspiro[4.6]undecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Oxa-3,8-diazaspiro[4.6]undecan-2-one
CID 56698910
3-Methoxy-3-propylpyrrolidine
CID 83815196
6-Oxa-2,9-diazaspiro[4.6]undecane
CID 118209572
9-Propan-2-yl-1-oxa-3,9-diazaspiro[4.6]undecane
CID 139359490
9-Methyl-1-oxa-3,9-diazaspiro[4.6]undecane
CID 139365126
3-(3-Methoxypyrrolidin-3-yl)propan-1-amine
CID 177005742
1-(4-methoxyazepan-4-yl)-N,N-dimethylmethanamine
CID 84660675
4-Methoxy-4-(pyrrolidin-1-ylmethyl)azepane
CID 84679270
(5R)-1-oxa-3,9-diazaspiro[4.6]undecan-2-one
CID 86327837
(5S)-1-oxa-3,9-diazaspiro[4.6]undecan-2-one
CID 86327839
(4-Methoxyazepan-4-yl)methanamine
CID 105431048
1-(4-methoxyazepan-4-yl)-N-methylmethanamine
CID 105435279

Frequently Asked Questions

What is the IUPAC name of 1-oxa-3,9-diazaspiro[4.6]undecane?
The IUPAC name of 1-oxa-3,9-diazaspiro[4.6]undecane (CID 138582776) is 1-oxa-3,9-diazaspiro[4.6]undecane.
What is the SMILES notation for 1-oxa-3,9-diazaspiro[4.6]undecane?
The canonical SMILES for 1-oxa-3,9-diazaspiro[4.6]undecane is C1CNCCC2(C1)CNCO2.
What is the InChIKey of 1-oxa-3,9-diazaspiro[4.6]undecane?
The InChIKey is QHRYENYECUXFQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-2-8(3-5-9-4-1)6-10-7-11-8/h9-10H,1-7H2.
What are the key properties of 1-oxa-3,9-diazaspiro[4.6]undecane?
1-oxa-3,9-diazaspiro[4.6]undecane has a molecular weight of 156.23 g/mol, XLogP of 0.08, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-oxa-3,9-diazaspiro[4.6]undecane is sourced from PubChem (CID 138582776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).