2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine

C10H20N2O — CID 129231152

IUPAC2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine
SMILESCC(C)N1CC2(CCOCC2N)C1
InChIInChI=1S/C10H20N2O/c1-8(2)12-6-10(7-12)3-4-13-5-9(10)11/h8-9H,3-7,11H2,1-2H3
InChIKeyOQPCUGDGQPPQBB-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.44
Rot. Bonds1

About 2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine

2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine (PubChem CID 129231152) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine.

Molecular Properties

Compound Name2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine
PubChem CID129231152
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine
SMILESCC(C)N1CC2(CCOCC2N)C1
InChIInChI=1S/C10H20N2O/c1-8(2)12-6-10(7-12)3-4-13-5-9(10)11/h8-9H,3-7,11H2,1-2H3
InChIKeyOQPCUGDGQPPQBB-UHFFFAOYSA-N
XLogP0.44
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine?
The IUPAC name of 2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine (CID 129231152) is 2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine.
What is the SMILES notation for 2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine?
The canonical SMILES for 2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine is CC(C)N1CC2(CCOCC2N)C1.
What is the InChIKey of 2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine?
The InChIKey is OQPCUGDGQPPQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8(2)12-6-10(7-12)3-4-13-5-9(10)11/h8-9H,3-7,11H2,1-2H3.
What are the key properties of 2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine?
2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine has a molecular weight of 184.28 g/mol, XLogP of 0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-7-oxa-2-azaspiro[3.5]nonan-5-amine is sourced from PubChem (CID 129231152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).