1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane

C16H31N — CID 55192290

IUPAC1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane
SMILESCC(C)CC1NCCC12CCC(C(C)C)CC2
InChIInChI=1S/C16H31N/c1-12(2)11-15-16(9-10-17-15)7-5-14(6-8-16)13(3)4/h12-15,17H,5-11H2,1-4H3
InChIKeyDGSUBFBFLIALOH-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.23
Rot. Bonds3

About 1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane

1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane (PubChem CID 55192290) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is 1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane.

Molecular Properties

Compound Name1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane
PubChem CID55192290
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC Name1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane
SMILESCC(C)CC1NCCC12CCC(C(C)C)CC2
InChIInChI=1S/C16H31N/c1-12(2)11-15-16(9-10-17-15)7-5-14(6-8-16)13(3)4/h12-15,17H,5-11H2,1-4H3
InChIKeyDGSUBFBFLIALOH-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.43
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane?
The IUPAC name of 1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane (CID 55192290) is 1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane.
What is the SMILES notation for 1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane?
The canonical SMILES for 1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane is CC(C)CC1NCCC12CCC(C(C)C)CC2.
What is the InChIKey of 1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane?
The InChIKey is DGSUBFBFLIALOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-12(2)11-15-16(9-10-17-15)7-5-14(6-8-16)13(3)4/h12-15,17H,5-11H2,1-4H3.
What are the key properties of 1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane?
1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane has a molecular weight of 237.43 g/mol, XLogP of 4.23, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)-8-propan-2-yl-2-azaspiro[4.5]decane is sourced from PubChem (CID 55192290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).