ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium

C10H21N2Rf- — CID 170571838

IUPACethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium
SMILESCC.C[CH-]N1CCC12CCCN2.[Rf]
InChIInChI=1S/C8H15N2.C2H6.Rf/c1-2-10-7-5-8(10)4-3-6-9-8;1-2;/h2,9H,3-7H2,1H3;1-2H3;/q-1;;
InChIKeyGARNEAFBLAXJEO-UHFFFAOYSA-N
MW436.29 g/mol
LogP1.98
Rot. Bonds1

About ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium

ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium (PubChem CID 170571838) has the molecular formula C10H21N2Rf- and a molecular weight of 436.29 g/mol. Its IUPAC name is ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium.

Molecular Properties

Compound Nameethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium
PubChem CID170571838
Molecular FormulaC10H21N2Rf-
Molecular Weight436.29 g/mol
Exact Mass436.29
IUPAC Nameethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium
SMILESCC.C[CH-]N1CCC12CCCN2.[Rf]
InChIInChI=1S/C8H15N2.C2H6.Rf/c1-2-10-7-5-8(10)4-3-6-9-8;1-2;/h2,9H,3-7H2,1H3;1-2H3;/q-1;;
InChIKeyGARNEAFBLAXJEO-UHFFFAOYSA-N
XLogP1.98
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.29
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium
CID 170571803
1-ethyl-1,6-diazaspiro[4.4]nonane
CID 170571632
6-propan-2-yl-1,6-diazaspiro[4.6]undecane
CID 170571646
ethane;8-methyl-1,8-diazaspiro[4.5]decane
CID 144717621
3,3-difluoro-2,2-dimethylpiperidine;hydrochloride
CID 115017011
ethane;9-methyl-1,9-diazaspiro[4.5]decane
CID 166075508
(4S)-5-propan-2-yl-1,5-diazaspiro[3.6]decane
CID 171423016
N'-ethyl-N,N-dimethyl-N'-[(2-methylpyrrolidin-2-yl)methyl]propane-1,3-diamine
CID 102994386
5,5-difluoro-1-azaspiro[5.6]dodecane
CID 155973408
[(2R)-2-methylpyrrolidin-2-yl]methanol
CID 51656383
(5S)-10-methyl-1,10-diazaspiro[4.6]undecane
CID 96850341
2-methylpyrrolidin-2-amine
CID 22046316

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium?
The IUPAC name of ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium (CID 170571838) is ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium.
What is the SMILES notation for ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium?
The canonical SMILES for ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium is CC.C[CH-]N1CCC12CCCN2.[Rf].
What is the InChIKey of ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium?
The InChIKey is GARNEAFBLAXJEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N2.C2H6.Rf/c1-2-10-7-5-8(10)4-3-6-9-8;1-2;/h2,9H,3-7H2,1H3;1-2H3;/q-1;;.
What are the key properties of ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium?
ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium has a molecular weight of 436.29 g/mol, XLogP of 1.98, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethyl-1,8-diazaspiro[3.4]octane;rutherfordium is sourced from PubChem (CID 170571838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).