cyclopentyl(quinolin-3-yl)methanone

C15H15NO — CID 54861205

IUPACcyclopentyl(quinolin-3-yl)methanone
SMILESO=C(c1cnc2ccccc2c1)C1CCCC1
InChIInChI=1S/C15H15NO/c17-15(11-5-1-2-6-11)13-9-12-7-3-4-8-14(12)16-10-13/h3-4,7-11H,1-2,5-6H2
InChIKeyAQOHFRKKGGDLTE-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.61
Rot. Bonds2

About cyclopentyl(quinolin-3-yl)methanone

cyclopentyl(quinolin-3-yl)methanone (PubChem CID 54861205) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is cyclopentyl(quinolin-3-yl)methanone.

Molecular Properties

Compound Namecyclopentyl(quinolin-3-yl)methanone
PubChem CID54861205
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Namecyclopentyl(quinolin-3-yl)methanone
SMILESO=C(c1cnc2ccccc2c1)C1CCCC1
InChIInChI=1S/C15H15NO/c17-15(11-5-1-2-6-11)13-9-12-7-3-4-8-14(12)16-10-13/h3-4,7-11H,1-2,5-6H2
InChIKeyAQOHFRKKGGDLTE-UHFFFAOYSA-N
XLogP3.61
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl(quinolin-3-yl)methanone?
The IUPAC name of cyclopentyl(quinolin-3-yl)methanone (CID 54861205) is cyclopentyl(quinolin-3-yl)methanone.
What is the SMILES notation for cyclopentyl(quinolin-3-yl)methanone?
The canonical SMILES for cyclopentyl(quinolin-3-yl)methanone is O=C(c1cnc2ccccc2c1)C1CCCC1.
What is the InChIKey of cyclopentyl(quinolin-3-yl)methanone?
The InChIKey is AQOHFRKKGGDLTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c17-15(11-5-1-2-6-11)13-9-12-7-3-4-8-14(12)16-10-13/h3-4,7-11H,1-2,5-6H2.
What are the key properties of cyclopentyl(quinolin-3-yl)methanone?
cyclopentyl(quinolin-3-yl)methanone has a molecular weight of 225.29 g/mol, XLogP of 3.61, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl(quinolin-3-yl)methanone is sourced from PubChem (CID 54861205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).