N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine

C10H20N2O — CID 156520850

IUPACN-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine
SMILESCNCC1CC2(COC2)CC(C)N1
InChIInChI=1S/C10H20N2O/c1-8-3-10(6-13-7-10)4-9(12-8)5-11-2/h8-9,11-12H,3-7H2,1-2H3
InChIKeyNYXQNMSVVXZFEX-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.36
Rot. Bonds2

About N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine

N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine (PubChem CID 156520850) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine
PubChem CID156520850
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine
SMILESCNCC1CC2(COC2)CC(C)N1
InChIInChI=1S/C10H20N2O/c1-8-3-10(6-13-7-10)4-9(12-8)5-11-2/h8-9,11-12H,3-7H2,1-2H3
InChIKeyNYXQNMSVVXZFEX-UHFFFAOYSA-N
XLogP0.36
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine?
The IUPAC name of N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine (CID 156520850) is N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine.
What is the SMILES notation for N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine?
The canonical SMILES for N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine is CNCC1CC2(COC2)CC(C)N1.
What is the InChIKey of N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine?
The InChIKey is NYXQNMSVVXZFEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8-3-10(6-13-7-10)4-9(12-8)5-11-2/h8-9,11-12H,3-7H2,1-2H3.
What are the key properties of N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine?
N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine has a molecular weight of 184.28 g/mol, XLogP of 0.36, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(8-methyl-2-oxa-7-azaspiro[3.5]nonan-6-yl)methanamine is sourced from PubChem (CID 156520850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).