3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane

C10H17NO — CID 119056895

IUPAC3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane
SMILESC1CC2(CCO1)CNC2C1CC1
InChIInChI=1S/C10H17NO/c1-2-8(1)9-10(7-11-9)3-5-12-6-4-10/h8-9,11H,1-7H2
InChIKeyRAXHZYMUQQRXCJ-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.16
Rot. Bonds1

About 3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane

3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane (PubChem CID 119056895) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane.

Molecular Properties

Compound Name3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane
PubChem CID119056895
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane
SMILESC1CC2(CCO1)CNC2C1CC1
InChIInChI=1S/C10H17NO/c1-2-8(1)9-10(7-11-9)3-5-12-6-4-10/h8-9,11H,1-7H2
InChIKeyRAXHZYMUQQRXCJ-UHFFFAOYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane?
The IUPAC name of 3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane (CID 119056895) is 3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane.
What is the SMILES notation for 3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane?
The canonical SMILES for 3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane is C1CC2(CCO1)CNC2C1CC1.
What is the InChIKey of 3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane?
The InChIKey is RAXHZYMUQQRXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-2-8(1)9-10(7-11-9)3-5-12-6-4-10/h8-9,11H,1-7H2.
What are the key properties of 3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane?
3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane has a molecular weight of 167.25 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-7-oxa-2-azaspiro[3.5]nonane is sourced from PubChem (CID 119056895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).