4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine

C8H16N2O — CID 146364725

IUPAC4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine
SMILESCC1CCOC12CNCC2N
InChIInChI=1S/C8H16N2O/c1-6-2-3-11-8(6)5-10-4-7(8)9/h6-7,10H,2-5,9H2,1H3
InChIKeyNRJYLHUAYFULFN-UHFFFAOYSA-N
MW156.23 g/mol
LogP-0.29
Rot. Bonds

About 4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine

4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine (PubChem CID 146364725) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine.

Molecular Properties

Compound Name4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine
PubChem CID146364725
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine
SMILESCC1CCOC12CNCC2N
InChIInChI=1S/C8H16N2O/c1-6-2-3-11-8(6)5-10-4-7(8)9/h6-7,10H,2-5,9H2,1H3
InChIKeyNRJYLHUAYFULFN-UHFFFAOYSA-N
XLogP-0.29
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine?
The IUPAC name of 4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine (CID 146364725) is 4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine.
What is the SMILES notation for 4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine?
The canonical SMILES for 4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine is CC1CCOC12CNCC2N.
What is the InChIKey of 4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine?
The InChIKey is NRJYLHUAYFULFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-6-2-3-11-8(6)5-10-4-7(8)9/h6-7,10H,2-5,9H2,1H3.
What are the key properties of 4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine?
4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine has a molecular weight of 156.23 g/mol, XLogP of -0.29, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-oxa-7-azaspiro[4.4]nonan-9-amine is sourced from PubChem (CID 146364725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).