7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane

C15H29NO — CID 155751089

IUPAC7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane
SMILESCC(C)CN1CCC2(CC1)CC(OC(C)C)C2
InChIInChI=1S/C15H29NO/c1-12(2)11-16-7-5-15(6-8-16)9-14(10-15)17-13(3)4/h12-14H,5-11H2,1-4H3
InChIKeyVKWUFJCWLPOESB-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.31
Rot. Bonds4

About 7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane

7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane (PubChem CID 155751089) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane.

Molecular Properties

Compound Name7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane
PubChem CID155751089
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane
SMILESCC(C)CN1CCC2(CC1)CC(OC(C)C)C2
InChIInChI=1S/C15H29NO/c1-12(2)11-16-7-5-15(6-8-16)9-14(10-15)17-13(3)4/h12-14H,5-11H2,1-4H3
InChIKeyVKWUFJCWLPOESB-UHFFFAOYSA-N
XLogP3.31
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane?
The IUPAC name of 7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane (CID 155751089) is 7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane.
What is the SMILES notation for 7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane?
The canonical SMILES for 7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane is CC(C)CN1CCC2(CC1)CC(OC(C)C)C2.
What is the InChIKey of 7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane?
The InChIKey is VKWUFJCWLPOESB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-12(2)11-16-7-5-15(6-8-16)9-14(10-15)17-13(3)4/h12-14H,5-11H2,1-4H3.
What are the key properties of 7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane?
7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane has a molecular weight of 239.40 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methylpropyl)-2-propan-2-yloxy-7-azaspiro[3.5]nonane is sourced from PubChem (CID 155751089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).