cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone

C14H23NO — CID 110871989

IUPACcyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone
SMILESO=C(C1CCC1)N1CCCC1C1CCCC1
InChIInChI=1S/C14H23NO/c16-14(12-7-3-8-12)15-10-4-9-13(15)11-5-1-2-6-11/h11-13H,1-10H2
InChIKeyRYNKICPIGYFMBZ-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.97
Rot. Bonds2

About cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone

cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone (PubChem CID 110871989) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Namecyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone
PubChem CID110871989
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Namecyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone
SMILESO=C(C1CCC1)N1CCCC1C1CCCC1
InChIInChI=1S/C14H23NO/c16-14(12-7-3-8-12)15-10-4-9-13(15)11-5-1-2-6-11/h11-13H,1-10H2
InChIKeyRYNKICPIGYFMBZ-UHFFFAOYSA-N
XLogP2.97
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone?
The IUPAC name of cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone (CID 110871989) is cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone.
What is the SMILES notation for cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone?
The canonical SMILES for cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone is O=C(C1CCC1)N1CCCC1C1CCCC1.
What is the InChIKey of cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone?
The InChIKey is RYNKICPIGYFMBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c16-14(12-7-3-8-12)15-10-4-9-13(15)11-5-1-2-6-11/h11-13H,1-10H2.
What are the key properties of cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone?
cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone has a molecular weight of 221.34 g/mol, XLogP of 2.97, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-(2-cyclopentylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 110871989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).