ethane;4-imidazol-1-ylpiperidine

C10H19N3 — CID 143122198

IUPACethane;4-imidazol-1-ylpiperidine
SMILESCC.c1cn(C2CCNCC2)cn1
InChIInChI=1S/C8H13N3.C2H6/c1-3-9-4-2-8(1)11-6-5-10-7-11;1-2/h5-9H,1-4H2;1-2H3
InChIKeyOSINAFCVCLKRAI-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.83
Rot. Bonds1

About ethane;4-imidazol-1-ylpiperidine

ethane;4-imidazol-1-ylpiperidine (PubChem CID 143122198) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is ethane;4-imidazol-1-ylpiperidine.

Molecular Properties

Compound Nameethane;4-imidazol-1-ylpiperidine
PubChem CID143122198
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Nameethane;4-imidazol-1-ylpiperidine
SMILESCC.c1cn(C2CCNCC2)cn1
InChIInChI=1S/C8H13N3.C2H6/c1-3-9-4-2-8(1)11-6-5-10-7-11;1-2/h5-9H,1-4H2;1-2H3
InChIKeyOSINAFCVCLKRAI-UHFFFAOYSA-N
XLogP1.83
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-imidazol-1-yl-1-methylpiperidine;4-imidazol-1-ylpiperidine
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1-cyclopentylimidazole;ethane;methanol
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4-imidazol-1-ylcyclohexan-1-amine
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1-(4-ethylcyclohexyl)imidazole
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1-(2,2-dimethylpropyl)-4-imidazol-1-ylpiperidine
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1-[(1S,5R)-3-bicyclo[3.1.0]hexanyl]imidazole
CID 126638711
4-imidazol-1-ylpiperidine-1-carbaldehyde
CID 56980966
3-imidazol-1-ylcyclobutan-1-ol
CID 131068227
1-(oxolan-3-yl)imidazole
CID 63810500
1-[(3S)-1-propan-2-ylpyrrolidin-3-yl]imidazole
CID 59927644
3-ethyl-9-imidazol-1-yl-3-azaspiro[5.5]undecane
CID 70846825

Frequently Asked Questions

What is the IUPAC name of ethane;4-imidazol-1-ylpiperidine?
The IUPAC name of ethane;4-imidazol-1-ylpiperidine (CID 143122198) is ethane;4-imidazol-1-ylpiperidine.
What is the SMILES notation for ethane;4-imidazol-1-ylpiperidine?
The canonical SMILES for ethane;4-imidazol-1-ylpiperidine is CC.c1cn(C2CCNCC2)cn1.
What is the InChIKey of ethane;4-imidazol-1-ylpiperidine?
The InChIKey is OSINAFCVCLKRAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3.C2H6/c1-3-9-4-2-8(1)11-6-5-10-7-11;1-2/h5-9H,1-4H2;1-2H3.
What are the key properties of ethane;4-imidazol-1-ylpiperidine?
ethane;4-imidazol-1-ylpiperidine has a molecular weight of 181.28 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-imidazol-1-ylpiperidine is sourced from PubChem (CID 143122198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).