1-cyclopentylimidazole;ethane;methanol

C11H22N2O — CID 144877752

IUPAC1-cyclopentylimidazole;ethane;methanol
SMILESCC.CO.c1cn(C2CCCC2)cn1
InChIInChI=1S/C8H12N2.C2H6.CH4O/c1-2-4-8(3-1)10-6-5-9-7-10;2*1-2/h5-8H,1-4H2;1-2H3;2H,1H3
InChIKeyHNHIIGOWXMKIAZ-UHFFFAOYSA-N
MW198.31 g/mol
LogP2.63
Rot. Bonds1

About 1-cyclopentylimidazole;ethane;methanol

1-cyclopentylimidazole;ethane;methanol (PubChem CID 144877752) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-cyclopentylimidazole;ethane;methanol.

Molecular Properties

Compound Name1-cyclopentylimidazole;ethane;methanol
PubChem CID144877752
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-cyclopentylimidazole;ethane;methanol
SMILESCC.CO.c1cn(C2CCCC2)cn1
InChIInChI=1S/C8H12N2.C2H6.CH4O/c1-2-4-8(3-1)10-6-5-9-7-10;2*1-2/h5-8H,1-4H2;1-2H3;2H,1H3
InChIKeyHNHIIGOWXMKIAZ-UHFFFAOYSA-N
XLogP2.63
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentylimidazole;ethane;methanol?
The IUPAC name of 1-cyclopentylimidazole;ethane;methanol (CID 144877752) is 1-cyclopentylimidazole;ethane;methanol.
What is the SMILES notation for 1-cyclopentylimidazole;ethane;methanol?
The canonical SMILES for 1-cyclopentylimidazole;ethane;methanol is CC.CO.c1cn(C2CCCC2)cn1.
What is the InChIKey of 1-cyclopentylimidazole;ethane;methanol?
The InChIKey is HNHIIGOWXMKIAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2.C2H6.CH4O/c1-2-4-8(3-1)10-6-5-9-7-10;2*1-2/h5-8H,1-4H2;1-2H3;2H,1H3.
What are the key properties of 1-cyclopentylimidazole;ethane;methanol?
1-cyclopentylimidazole;ethane;methanol has a molecular weight of 198.31 g/mol, XLogP of 2.63, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylimidazole;ethane;methanol is sourced from PubChem (CID 144877752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).