5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one

C10H17NO2 — CID 171846465

IUPAC5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one
SMILESCC(C)N1C(=O)CCCC12COC2
InChIInChI=1S/C10H17NO2/c1-8(2)11-9(12)4-3-5-10(11)6-13-7-10/h8H,3-7H2,1-2H3
InChIKeyHGEUNAWMDKMTBI-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.18
Rot. Bonds1

About 5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one

5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one (PubChem CID 171846465) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one.

Molecular Properties

Compound Name5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one
PubChem CID171846465
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one
SMILESCC(C)N1C(=O)CCCC12COC2
InChIInChI=1S/C10H17NO2/c1-8(2)11-9(12)4-3-5-10(11)6-13-7-10/h8H,3-7H2,1-2H3
InChIKeyHGEUNAWMDKMTBI-UHFFFAOYSA-N
XLogP1.18
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one?
The IUPAC name of 5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one (CID 171846465) is 5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one.
What is the SMILES notation for 5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one?
The canonical SMILES for 5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one is CC(C)N1C(=O)CCCC12COC2.
What is the InChIKey of 5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one?
The InChIKey is HGEUNAWMDKMTBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-8(2)11-9(12)4-3-5-10(11)6-13-7-10/h8H,3-7H2,1-2H3.
What are the key properties of 5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one?
5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one has a molecular weight of 183.25 g/mol, XLogP of 1.18, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-2-oxa-5-azaspiro[3.5]nonan-6-one is sourced from PubChem (CID 171846465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).