1-oxaspiro[4.5]decane;2-phenylacetamide

C17H25NO2 — CID 21117982

IUPAC1-oxaspiro[4.5]decane;2-phenylacetamide
SMILESC1CCC2(CC1)CCCO2.NC(=O)Cc1ccccc1
InChIInChI=1S/C9H16O.C8H9NO/c1-2-5-9(6-3-1)7-4-8-10-9;9-8(10)6-7-4-2-1-3-5-7/h1-8H2;1-5H,6H2,(H2,9,10)
InChIKeyWRIIYRWGAKJABR-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.21
Rot. Bonds2

About 1-oxaspiro[4.5]decane;2-phenylacetamide

1-oxaspiro[4.5]decane;2-phenylacetamide (PubChem CID 21117982) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is 1-oxaspiro[4.5]decane;2-phenylacetamide.

Molecular Properties

Compound Name1-oxaspiro[4.5]decane;2-phenylacetamide
PubChem CID21117982
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name1-oxaspiro[4.5]decane;2-phenylacetamide
SMILESC1CCC2(CC1)CCCO2.NC(=O)Cc1ccccc1
InChIInChI=1S/C9H16O.C8H9NO/c1-2-5-9(6-3-1)7-4-8-10-9;9-8(10)6-7-4-2-1-3-5-7/h1-8H2;1-5H,6H2,(H2,9,10)
InChIKeyWRIIYRWGAKJABR-UHFFFAOYSA-N
XLogP3.21
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-oxaspiro[5.5]undecan-4-yl)-2-phenylethanone
CID 79912329
2-benzyloxolane-2-carboxylic acid
CID 18467992
2-benzyloxane-2-carboxylic acid
CID 12030266
2-(1-oxaspiro[4.5]decan-8-ylidene)-2-(phenylmethoxycarbonylamino)acetic acid
CID 66718218
8-O-benzyl 7-O-methyl 1-oxaspiro[4.4]nonane-7,8-dicarboxylate
CID 21307041
2-phenylacetamide;pyridine
CID 22283001
1-(1-aminocyclopentyl)-3-phenylpropan-2-one
CID 116578581
1-[8-(hydroxymethyl)-1,4-dioxaspiro[4.5]decan-8-yl]-2-phenylethanone
CID 144944742
2-(3-fluorophenyl)-1-(1-oxa-9-azaspiro[5.5]undecan-9-yl)ethanone
CID 110203850
1-[(6R)-4-methyl-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl]-2-phenylethanone
CID 97449072
2-(2-fluorophenyl)-1-(1-oxa-9-azaspiro[5.5]undecan-9-yl)ethanone
CID 110203853
2-benzyl-6-oxa-2-azaspiro[4.5]decane
CID 82390526

Frequently Asked Questions

What is the IUPAC name of 1-oxaspiro[4.5]decane;2-phenylacetamide?
The IUPAC name of 1-oxaspiro[4.5]decane;2-phenylacetamide (CID 21117982) is 1-oxaspiro[4.5]decane;2-phenylacetamide.
What is the SMILES notation for 1-oxaspiro[4.5]decane;2-phenylacetamide?
The canonical SMILES for 1-oxaspiro[4.5]decane;2-phenylacetamide is C1CCC2(CC1)CCCO2.NC(=O)Cc1ccccc1.
What is the InChIKey of 1-oxaspiro[4.5]decane;2-phenylacetamide?
The InChIKey is WRIIYRWGAKJABR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O.C8H9NO/c1-2-5-9(6-3-1)7-4-8-10-9;9-8(10)6-7-4-2-1-3-5-7/h1-8H2;1-5H,6H2,(H2,9,10).
What are the key properties of 1-oxaspiro[4.5]decane;2-phenylacetamide?
1-oxaspiro[4.5]decane;2-phenylacetamide has a molecular weight of 275.39 g/mol, XLogP of 3.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-oxaspiro[4.5]decane;2-phenylacetamide is sourced from PubChem (CID 21117982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).