8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione

C15H24N2O3 — CID 114469832

IUPAC8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESC=C(C)COCCN1C(=O)C2(CCCC2)NC(=O)C1C
InChIInChI=1S/C15H24N2O3/c1-11(2)10-20-9-8-17-12(3)13(18)16-15(14(17)19)6-4-5-7-15/h12H,1,4-10H2,2-3H3,(H,16,18)
InChIKeyPBCRUZFAXHYKEY-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.24
Rot. Bonds5

About 8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione

8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 114469832) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID114469832
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESC=C(C)COCCN1C(=O)C2(CCCC2)NC(=O)C1C
InChIInChI=1S/C15H24N2O3/c1-11(2)10-20-9-8-17-12(3)13(18)16-15(14(17)19)6-4-5-7-15/h12H,1,4-10H2,2-3H3,(H,16,18)
InChIKeyPBCRUZFAXHYKEY-UHFFFAOYSA-N
XLogP1.24
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-ethyl-3,6-dimethyl-1-[2-(2-methylprop-2-enoxy)ethyl]piperazine-2,5-dione
CID 114469771
9-(3-ethoxypropyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64958654
8-methyl-9-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886681
8-methyl-9-(3-methylbutyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887057
8-methyl-9-octyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886104
8-methyl-9-[2-(trifluoromethylsulfanyl)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione
CID 116627679
8-methyl-9-(2,2,2-trifluoroethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887442
4-(3-chloro-2-methylprop-2-enyl)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 106440744
8-methyl-9-(2-thiomorpholin-4-ylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 106326405
9-hex-5-ynyl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 106210771
4-(cyclopropylmethyl)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64887432
9-(2-ethoxy-2-methylpropyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 114944504

Frequently Asked Questions

What is the IUPAC name of 8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione (CID 114469832) is 8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione is C=C(C)COCCN1C(=O)C2(CCCC2)NC(=O)C1C.
What is the InChIKey of 8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is PBCRUZFAXHYKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-11(2)10-20-9-8-17-12(3)13(18)16-15(14(17)19)6-4-5-7-15/h12H,1,4-10H2,2-3H3,(H,16,18).
What are the key properties of 8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione?
8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 280.37 g/mol, XLogP of 1.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-9-[2-(2-methylprop-2-enoxy)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 114469832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).