(4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene

C10H17NO — CID 173179058

IUPAC(4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene
SMILESCC(C)[C@H]1N=COC12CCCC2
InChIInChI=1S/C10H17NO/c1-8(2)9-10(12-7-11-9)5-3-4-6-10/h7-9H,3-6H2,1-2H3/t9-/m1/s1
InChIKeyXWDFBCXABQTZMI-SECBINFHSA-N
MW167.25 g/mol
LogP2.38
Rot. Bonds1

About (4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene

(4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene (PubChem CID 173179058) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is (4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene.

Molecular Properties

Compound Name(4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene
PubChem CID173179058
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name(4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene
SMILESCC(C)[C@H]1N=COC12CCCC2
InChIInChI=1S/C10H17NO/c1-8(2)9-10(12-7-11-9)5-3-4-6-10/h7-9H,3-6H2,1-2H3/t9-/m1/s1
InChIKeyXWDFBCXABQTZMI-SECBINFHSA-N
XLogP2.38
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene?
The IUPAC name of (4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene (CID 173179058) is (4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene.
What is the SMILES notation for (4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene?
The canonical SMILES for (4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene is CC(C)[C@H]1N=COC12CCCC2.
What is the InChIKey of (4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene?
The InChIKey is XWDFBCXABQTZMI-SECBINFHSA-N. The full InChI is InChI=1S/C10H17NO/c1-8(2)9-10(12-7-11-9)5-3-4-6-10/h7-9H,3-6H2,1-2H3/t9-/m1/s1.
What are the key properties of (4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene?
(4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene has a molecular weight of 167.25 g/mol, XLogP of 2.38, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-propan-2-yl-1-oxa-3-azaspiro[4.4]non-2-ene is sourced from PubChem (CID 173179058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).