potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane

C13H27KN2 — CID 154678990

IUPACpotassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane
SMILESCC.CCN1CCC2(CC[N-]CC2)CC1.[K+]
InChIInChI=1S/C11H21N2.C2H6.K/c1-2-13-9-5-11(6-10-13)3-7-12-8-4-11;1-2;/h2-10H2,1H3;1-2H3;/q-1;;+1
InChIKeyVTSXJSPWJQDVHY-UHFFFAOYSA-N
MW250.47 g/mol
LogP0.29
Rot. Bonds1

About potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane

potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane (PubChem CID 154678990) has the molecular formula C13H27KN2 and a molecular weight of 250.47 g/mol. Its IUPAC name is potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane.

Molecular Properties

Compound Namepotassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane
PubChem CID154678990
Molecular FormulaC13H27KN2
Molecular Weight250.47 g/mol
Exact Mass250.18
IUPAC Namepotassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane
SMILESCC.CCN1CCC2(CC[N-]CC2)CC1.[K+]
InChIInChI=1S/C11H21N2.C2H6.K/c1-2-13-9-5-11(6-10-13)3-7-12-8-4-11;1-2;/h2-10H2,1H3;1-2H3;/q-1;;+1
InChIKeyVTSXJSPWJQDVHY-UHFFFAOYSA-N
XLogP0.29
TPSA17.34 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.47
LogP ≤ 50.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,9-diethyl-3,9-diazaspiro[5.5]undecane
CID 20622591
potassium 1-ethylpiperazin-4-ide
CID 143767667
1-ethylpiperazin-4-ide;rhenium
CID 145364124
ethane;7-ethyl-2-methyl-7-aza-2-azoniaspiro[3.5]nonane
CID 156749858
1-ethyl-4-fluoro-4-iodopiperidine
CID 147786451
1-ethyl-4,4-dimethylpiperidine;hydrate
CID 178113144
8-ethyl-2,8-diazaspiro[4.5]decane
CID 46318290
1-(9-ethyl-3,9-diazaspiro[5.5]undecan-3-yl)-2-methylpropan-1-one
CID 156795061
1,4,7,10,13,16-hexaethyl-1,4,7,10,13,16-hexazacyclooctadecane
CID 66730221
1-ethyl-4-fluoro-4-propan-2-ylpiperidine
CID 163258367
ethane;7-propyl-7-azaspiro[3.5]nonane
CID 176563590
1,4-diethyl-4-iodopiperidine
CID 118535824

Frequently Asked Questions

What is the IUPAC name of potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane?
The IUPAC name of potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane (CID 154678990) is potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane.
What is the SMILES notation for potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane?
The canonical SMILES for potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane is CC.CCN1CCC2(CC[N-]CC2)CC1.[K+].
What is the InChIKey of potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane?
The InChIKey is VTSXJSPWJQDVHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N2.C2H6.K/c1-2-13-9-5-11(6-10-13)3-7-12-8-4-11;1-2;/h2-10H2,1H3;1-2H3;/q-1;;+1.
What are the key properties of potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane?
potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane has a molecular weight of 250.47 g/mol, XLogP of 0.29, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;ethane;3-ethyl-3-aza-9-azanidaspiro[5.5]undecane is sourced from PubChem (CID 154678990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).