N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine

C13H26N2O — CID 58797576

IUPACN,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine
SMILESCN(C)CCCN1CCC2(CCOCC2)C1
InChIInChI=1S/C13H26N2O/c1-14(2)7-3-8-15-9-4-13(12-15)5-10-16-11-6-13/h3-12H2,1-2H3
InChIKeyIVHLOLVWGHJIEX-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.44
Rot. Bonds4

About N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine

N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine (PubChem CID 58797576) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine
PubChem CID58797576
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine
SMILESCN(C)CCCN1CCC2(CCOCC2)C1
InChIInChI=1S/C13H26N2O/c1-14(2)7-3-8-15-9-4-13(12-15)5-10-16-11-6-13/h3-12H2,1-2H3
InChIKeyIVHLOLVWGHJIEX-UHFFFAOYSA-N
XLogP1.44
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-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,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine?
The IUPAC name of N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine (CID 58797576) is N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine.
What is the SMILES notation for N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine?
The canonical SMILES for N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine is CN(C)CCCN1CCC2(CCOCC2)C1.
What is the InChIKey of N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine?
The InChIKey is IVHLOLVWGHJIEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-14(2)7-3-8-15-9-4-13(12-15)5-10-16-11-6-13/h3-12H2,1-2H3.
What are the key properties of N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine?
N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine has a molecular weight of 226.36 g/mol, XLogP of 1.44, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(8-oxa-2-azaspiro[4.5]decan-2-yl)propan-1-amine is sourced from PubChem (CID 58797576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).