N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine

C10H19NO2 — CID 83852999

IUPACN-methyl-1,5-dioxaspiro[5.5]undecan-10-amine
SMILESCNC1CCCC2(C1)OCCCO2
InChIInChI=1S/C10H19NO2/c1-11-9-4-2-5-10(8-9)12-6-3-7-13-10/h9,11H,2-8H2,1H3
InChIKeyVHMGGGLNSSCHEO-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.28
Rot. Bonds1

About N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine

N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine (PubChem CID 83852999) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine.

Molecular Properties

Compound NameN-methyl-1,5-dioxaspiro[5.5]undecan-10-amine
PubChem CID83852999
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN-methyl-1,5-dioxaspiro[5.5]undecan-10-amine
SMILESCNC1CCCC2(C1)OCCCO2
InChIInChI=1S/C10H19NO2/c1-11-9-4-2-5-10(8-9)12-6-3-7-13-10/h9,11H,2-8H2,1H3
InChIKeyVHMGGGLNSSCHEO-UHFFFAOYSA-N
XLogP1.28
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine?
The IUPAC name of N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine (CID 83852999) is N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine.
What is the SMILES notation for N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine?
The canonical SMILES for N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine is CNC1CCCC2(C1)OCCCO2.
What is the InChIKey of N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine?
The InChIKey is VHMGGGLNSSCHEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-11-9-4-2-5-10(8-9)12-6-3-7-13-10/h9,11H,2-8H2,1H3.
What are the key properties of N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine?
N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine has a molecular weight of 185.27 g/mol, XLogP of 1.28, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1,5-dioxaspiro[5.5]undecan-10-amine is sourced from PubChem (CID 83852999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).