N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine

C10H19NO — CID 131182851

IUPACN,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine
SMILESCN(C)CC1CC12CCOCC2
InChIInChI=1S/C10H19NO/c1-11(2)8-9-7-10(9)3-5-12-6-4-10/h9H,3-8H2,1-2H3
InChIKeyWYOISCTZDILOKA-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.36
Rot. Bonds2

About N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine

N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine (PubChem CID 131182851) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine
PubChem CID131182851
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine
SMILESCN(C)CC1CC12CCOCC2
InChIInChI=1S/C10H19NO/c1-11(2)8-9-7-10(9)3-5-12-6-4-10/h9H,3-8H2,1-2H3
InChIKeyWYOISCTZDILOKA-UHFFFAOYSA-N
XLogP1.36
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine?
The IUPAC name of N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine (CID 131182851) is N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine is CN(C)CC1CC12CCOCC2.
What is the InChIKey of N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine?
The InChIKey is WYOISCTZDILOKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-11(2)8-9-7-10(9)3-5-12-6-4-10/h9H,3-8H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine?
N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine has a molecular weight of 169.27 g/mol, XLogP of 1.36, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(6-oxaspiro[2.5]octan-2-yl)methanamine is sourced from PubChem (CID 131182851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).