2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone

C11H16N2O — CID 573569

IUPAC2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone
SMILESO=C(CC1CCCCC1)c1cnc[nH]1
InChIInChI=1S/C11H16N2O/c14-11(10-7-12-8-13-10)6-9-4-2-1-3-5-9/h7-9H,1-6H2,(H,12,13)
InChIKeyYZNJOCLCSVNTSW-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.56
Rot. Bonds3

About 2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone

2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone (PubChem CID 573569) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone.

Molecular Properties

Compound Name2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone
PubChem CID573569
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone
SMILESO=C(CC1CCCCC1)c1cnc[nH]1
InChIInChI=1S/C11H16N2O/c14-11(10-7-12-8-13-10)6-9-4-2-1-3-5-9/h7-9H,1-6H2,(H,12,13)
InChIKeyYZNJOCLCSVNTSW-UHFFFAOYSA-N
XLogP2.56
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone?
The IUPAC name of 2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone (CID 573569) is 2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone.
What is the SMILES notation for 2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone?
The canonical SMILES for 2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone is O=C(CC1CCCCC1)c1cnc[nH]1.
What is the InChIKey of 2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone?
The InChIKey is YZNJOCLCSVNTSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c14-11(10-7-12-8-13-10)6-9-4-2-1-3-5-9/h7-9H,1-6H2,(H,12,13).
What are the key properties of 2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone?
2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone has a molecular weight of 192.26 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(1H-imidazol-5-yl)ethanone is sourced from PubChem (CID 573569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).