5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane

C11H21N — CID 149057571

IUPAC5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane
SMILESCC(C)C1CCC2(CC2)CN1C
InChIInChI=1S/C11H21N/c1-9(2)10-4-5-11(6-7-11)8-12(10)3/h9-10H,4-8H2,1-3H3
InChIKeyQLDHKQNMHAOUTM-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.52
Rot. Bonds1

About 5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane

5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane (PubChem CID 149057571) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane.

Molecular Properties

Compound Name5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane
PubChem CID149057571
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane
SMILESCC(C)C1CCC2(CC2)CN1C
InChIInChI=1S/C11H21N/c1-9(2)10-4-5-11(6-7-11)8-12(10)3/h9-10H,4-8H2,1-3H3
InChIKeyQLDHKQNMHAOUTM-UHFFFAOYSA-N
XLogP2.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane?
The IUPAC name of 5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane (CID 149057571) is 5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane.
What is the SMILES notation for 5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane?
The canonical SMILES for 5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane is CC(C)C1CCC2(CC2)CN1C.
What is the InChIKey of 5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane?
The InChIKey is QLDHKQNMHAOUTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-9(2)10-4-5-11(6-7-11)8-12(10)3/h9-10H,4-8H2,1-3H3.
What are the key properties of 5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane?
5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane has a molecular weight of 167.30 g/mol, XLogP of 2.52, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-propan-2-yl-5-azaspiro[2.5]octane is sourced from PubChem (CID 149057571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).