3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one

C12H22N2O3 — CID 142283729

IUPAC3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one
SMILESCC1CCC2(CC1)CNC2=O.NC(=O)CCO
InChIInChI=1S/C9H15NO.C3H7NO2/c1-7-2-4-9(5-3-7)6-10-8(9)11;4-3(6)1-2-5/h7H,2-6H2,1H3,(H,10,11);5H,1-2H2,(H2,4,6)
InChIKeyZLEMNLIQUVMJLM-UHFFFAOYSA-N
MW242.32 g/mol
LogP0.17
Rot. Bonds2

About 3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one

3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one (PubChem CID 142283729) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one.

Molecular Properties

Compound Name3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one
PubChem CID142283729
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC Name3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one
SMILESCC1CCC2(CC1)CNC2=O.NC(=O)CCO
InChIInChI=1S/C9H15NO.C3H7NO2/c1-7-2-4-9(5-3-7)6-10-8(9)11;4-3(6)1-2-5/h7H,2-6H2,1H3,(H,10,11);5H,1-2H2,(H2,4,6)
InChIKeyZLEMNLIQUVMJLM-UHFFFAOYSA-N
XLogP0.17
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 171080818
butanediamide;pyrrolidine-2,5-dione
CID 22719144
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CID 79348734
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CID 65121718
9-methyl-1,4-diazaspiro[5.5]undecan-5-one
CID 54773629
3-(3-hydroxypropyl)-8-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
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2-amino-1-(1,4-dimethylcyclohexyl)ethanone
CID 70477833

Frequently Asked Questions

What is the IUPAC name of 3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one?
The IUPAC name of 3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one (CID 142283729) is 3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one.
What is the SMILES notation for 3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one?
The canonical SMILES for 3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one is CC1CCC2(CC1)CNC2=O.NC(=O)CCO.
What is the InChIKey of 3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one?
The InChIKey is ZLEMNLIQUVMJLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO.C3H7NO2/c1-7-2-4-9(5-3-7)6-10-8(9)11;4-3(6)1-2-5/h7H,2-6H2,1H3,(H,10,11);5H,1-2H2,(H2,4,6).
What are the key properties of 3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one?
3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one has a molecular weight of 242.32 g/mol, XLogP of 0.17, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one is sourced from PubChem (CID 142283729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).