1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione

C15H22N4O2 — CID 64881288

IUPAC1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCc1nccn1CCN1C(=O)CNC(=O)C12CCCCC2
InChIInChI=1S/C15H22N4O2/c1-12-16-7-8-18(12)9-10-19-13(20)11-17-14(21)15(19)5-3-2-4-6-15/h7-8H,2-6,9-11H2,1H3,(H,17,21)
InChIKeyNQDWEPQPWMGKHH-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.85
Rot. Bonds3

About 1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione

1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione (PubChem CID 64881288) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione.

Molecular Properties

Compound Name1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione
PubChem CID64881288
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCc1nccn1CCN1C(=O)CNC(=O)C12CCCCC2
InChIInChI=1S/C15H22N4O2/c1-12-16-7-8-18(12)9-10-19-13(20)11-17-14(21)15(19)5-3-2-4-6-15/h7-8H,2-6,9-11H2,1H3,(H,17,21)
InChIKeyNQDWEPQPWMGKHH-UHFFFAOYSA-N
XLogP0.85
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione with MolForge

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Related Compounds

6-[2-(1-methylimidazol-2-yl)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione
CID 114532500
6-(2-methylsulfonylethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64880891
1-(3-methoxy-3-methylbutyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 103016990
6-[(1-methylpyrazol-4-yl)methyl]-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64881279
6-[2-(trifluoromethylsulfanyl)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione
CID 116627705
1-amino-N-[2-(2-methylimidazol-1-yl)ethyl]cyclohexane-1-carboxamide
CID 119869306
1-[2-(2-methylimidazol-1-yl)ethyl]piperidine
CID 61225679
1-butyl-1,4,9-triazaspiro[5.5]undecane-2,5-dione
CID 142170444
N-[(1-methylcyclopentyl)methyl]-2-(2-methylimidazol-1-yl)ethanamine
CID 63821869
1-[(3-methylphenyl)methyl]-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64880512
[1-[2-(2-methylimidazol-1-yl)ethylamino]cyclohexyl]methanol
CID 55082128
(4S)-4-hydroxy-4-methyl-3-[3-(2-methylimidazol-1-yl)propyl]-1-oxa-3-azaspiro[4.5]decan-2-one
CID 714795

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione?
The IUPAC name of 1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione (CID 64881288) is 1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione.
What is the SMILES notation for 1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione?
The canonical SMILES for 1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione is Cc1nccn1CCN1C(=O)CNC(=O)C12CCCCC2.
What is the InChIKey of 1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione?
The InChIKey is NQDWEPQPWMGKHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-12-16-7-8-18(12)9-10-19-13(20)11-17-14(21)15(19)5-3-2-4-6-15/h7-8H,2-6,9-11H2,1H3,(H,17,21).
What are the key properties of 1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione?
1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione has a molecular weight of 290.37 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methylimidazol-1-yl)ethyl]-1,4-diazaspiro[5.5]undecane-2,5-dione is sourced from PubChem (CID 64881288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).