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

C10H14N2O — CID 573560

IUPAC2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone
SMILESO=C(CC1CCCC1)c1cnc[nH]1
InChIInChI=1S/C10H14N2O/c13-10(9-6-11-7-12-9)5-8-3-1-2-4-8/h6-8H,1-5H2,(H,11,12)
InChIKeyANGNJTMSOJOKGL-UHFFFAOYSA-N
MW178.24 g/mol
LogP2.17
Rot. Bonds3

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

2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone (PubChem CID 573560) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is 2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone.

Molecular Properties

Compound Name2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone
PubChem CID573560
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone
SMILESO=C(CC1CCCC1)c1cnc[nH]1
InChIInChI=1S/C10H14N2O/c13-10(9-6-11-7-12-9)5-8-3-1-2-4-8/h6-8H,1-5H2,(H,11,12)
InChIKeyANGNJTMSOJOKGL-UHFFFAOYSA-N
XLogP2.17
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone?
The IUPAC name of 2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone (CID 573560) is 2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone.
What is the SMILES notation for 2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone?
The canonical SMILES for 2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone is O=C(CC1CCCC1)c1cnc[nH]1.
What is the InChIKey of 2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone?
The InChIKey is ANGNJTMSOJOKGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c13-10(9-6-11-7-12-9)5-8-3-1-2-4-8/h6-8H,1-5H2,(H,11,12).
What are the key properties of 2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone?
2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone has a molecular weight of 178.24 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(1H-imidazol-5-yl)ethanone is sourced from PubChem (CID 573560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).