2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine

C13H26N2O — CID 130315683

IUPAC2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine
SMILESCC(C)(C)NCC1CCC2(CCNCC2)O1
InChIInChI=1S/C13H26N2O/c1-12(2,3)15-10-11-4-5-13(16-11)6-8-14-9-7-13/h11,14-15H,4-10H2,1-3H3
InChIKeyKABNOTRIBLWIAB-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.68
Rot. Bonds2

About 2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine

2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine (PubChem CID 130315683) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine
PubChem CID130315683
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine
SMILESCC(C)(C)NCC1CCC2(CCNCC2)O1
InChIInChI=1S/C13H26N2O/c1-12(2,3)15-10-11-4-5-13(16-11)6-8-14-9-7-13/h11,14-15H,4-10H2,1-3H3
InChIKeyKABNOTRIBLWIAB-UHFFFAOYSA-N
XLogP1.68
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine?
The IUPAC name of 2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine (CID 130315683) is 2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine.
What is the SMILES notation for 2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine?
The canonical SMILES for 2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine is CC(C)(C)NCC1CCC2(CCNCC2)O1.
What is the InChIKey of 2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine?
The InChIKey is KABNOTRIBLWIAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-12(2,3)15-10-11-4-5-13(16-11)6-8-14-9-7-13/h11,14-15H,4-10H2,1-3H3.
What are the key properties of 2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine?
2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine has a molecular weight of 226.36 g/mol, XLogP of 1.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)propan-2-amine is sourced from PubChem (CID 130315683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).