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

C10H14N2O — CID 82372596

IUPAC1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone
SMILESCC(=O)c1cnc(C2CCCC2)[nH]1
InChIInChI=1S/C10H14N2O/c1-7(13)9-6-11-10(12-9)8-4-2-3-5-8/h6,8H,2-5H2,1H3,(H,11,12)
InChIKeyMTQDPSJLPSQWKC-UHFFFAOYSA-N
MW178.24 g/mol
LogP2.27
Rot. Bonds2

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

1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone (PubChem CID 82372596) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is 1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone.

Molecular Properties

Compound Name1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone
PubChem CID82372596
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone
SMILESCC(=O)c1cnc(C2CCCC2)[nH]1
InChIInChI=1S/C10H14N2O/c1-7(13)9-6-11-10(12-9)8-4-2-3-5-8/h6,8H,2-5H2,1H3,(H,11,12)
InChIKeyMTQDPSJLPSQWKC-UHFFFAOYSA-N
XLogP2.27
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone?
The IUPAC name of 1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone (CID 82372596) is 1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone.
What is the SMILES notation for 1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone?
The canonical SMILES for 1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone is CC(=O)c1cnc(C2CCCC2)[nH]1.
What is the InChIKey of 1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone?
The InChIKey is MTQDPSJLPSQWKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-7(13)9-6-11-10(12-9)8-4-2-3-5-8/h6,8H,2-5H2,1H3,(H,11,12).
What are the key properties of 1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone?
1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone has a molecular weight of 178.24 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopentyl-1H-imidazol-5-yl)ethanone is sourced from PubChem (CID 82372596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).