2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one

C15H24O2 — CID 115787764

IUPAC2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one
SMILESCC(C(=O)C1CCOC2(CCCC2)C1)C1CC1
InChIInChI=1S/C15H24O2/c1-11(12-4-5-12)14(16)13-6-9-17-15(10-13)7-2-3-8-15/h11-13H,2-10H2,1H3
InChIKeyDURNHPFYZZIQIB-UHFFFAOYSA-N
MW236.35 g/mol
LogP3.34
Rot. Bonds3

About 2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one

2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one (PubChem CID 115787764) has the molecular formula C15H24O2 and a molecular weight of 236.35 g/mol. Its IUPAC name is 2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one.

Molecular Properties

Compound Name2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one
PubChem CID115787764
Molecular FormulaC15H24O2
Molecular Weight236.35 g/mol
Exact Mass236.18
IUPAC Name2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one
SMILESCC(C(=O)C1CCOC2(CCCC2)C1)C1CC1
InChIInChI=1S/C15H24O2/c1-11(12-4-5-12)14(16)13-6-9-17-15(10-13)7-2-3-8-15/h11-13H,2-10H2,1H3
InChIKeyDURNHPFYZZIQIB-UHFFFAOYSA-N
XLogP3.34
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.35
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-hydroxy-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one
CID 103451398
2-amino-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one
CID 116551698
2-amino-1-(1-oxaspiro[5.5]undecan-4-yl)propan-1-one
CID 116551697
3-amino-2-methyl-1-(1-oxaspiro[5.5]undecan-4-yl)propan-1-one
CID 116564442
2-(aminomethyl)-3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)butan-1-one
CID 116573884
3-amino-2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-1-one
CID 116564393
3-(6-oxaspiro[4.5]decan-9-yl)butan-2-one
CID 79893658
2-(1-oxaspiro[5.5]undecan-4-yl)propanoic acid
CID 79901459
4-amino-2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)butan-1-one
CID 116594794
2-(aminomethyl)-4-methyl-1-(1-oxaspiro[5.5]undecan-4-yl)pentan-1-one
CID 116597880
(2,2-dimethylcyclopropyl)-(1-oxaspiro[5.5]undecan-4-yl)methanone
CID 107003969
1-oxaspiro[5.5]undecane-4-carboxylic acid
CID 79904011

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one?
The IUPAC name of 2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one (CID 115787764) is 2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one.
What is the SMILES notation for 2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one?
The canonical SMILES for 2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one is CC(C(=O)C1CCOC2(CCCC2)C1)C1CC1.
What is the InChIKey of 2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one?
The InChIKey is DURNHPFYZZIQIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O2/c1-11(12-4-5-12)14(16)13-6-9-17-15(10-13)7-2-3-8-15/h11-13H,2-10H2,1H3.
What are the key properties of 2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one?
2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one has a molecular weight of 236.35 g/mol, XLogP of 3.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-one is sourced from PubChem (CID 115787764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).