2-Azaspiro(4.5)decan-1-one

C₉H₁₅NOCAS 1005-85-2153.22 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₅NO
Molar mass: 153.22 g/mol
Exact mass: 153.1154 Da
logP: 1.46Crippen estimate
Polar surface area: 29.1 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

1005-85-2

SMILES

C1CCC2(CC1)CCNC2=O

InChIKey

UYZFAPXBVNFJFD-UHFFFAOYSA-N

InChI

InChI=1S/C9H15NO/c11-8-9(6-7-10-8)4-2-1-3-5-9/h1-7H2,(H,10,11)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

3,3-Pentamethylene-2-pyrrolidinone

Work with 2-Azaspiro(4.5)decan-1-one

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

tert-Butyl 6-oxo-2,7-diazaspiro[4.4]nonane-2-carboxylate1194376-44-739 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Trimethylphenylammonium hydroxide1899-02-1 Pseudopelletierine552-70-5 2-Azaspiro[4.5]decan-3-one64744-50-9 1-Morpholinocyclopentene936-52-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook