cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone

C10H17NO — CID 45115989

IUPACcyclopentyl-[(2S)-pyrrolidin-2-yl]methanone
SMILESO=C(C1CCCC1)[C@@H]1CCCN1
InChIInChI=1S/C10H17NO/c12-10(8-4-1-2-5-8)9-6-3-7-11-9/h8-9,11H,1-7H2/t9-/m0/s1
InChIKeyPAYGTTPEIKDFGU-VIFPVBQESA-N
MW167.25 g/mol
LogP1.50
Rot. Bonds2

About cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone

cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone (PubChem CID 45115989) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[(2S)-pyrrolidin-2-yl]methanone
PubChem CID45115989
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Namecyclopentyl-[(2S)-pyrrolidin-2-yl]methanone
SMILESO=C(C1CCCC1)[C@@H]1CCCN1
InChIInChI=1S/C10H17NO/c12-10(8-4-1-2-5-8)9-6-3-7-11-9/h8-9,11H,1-7H2/t9-/m0/s1
InChIKeyPAYGTTPEIKDFGU-VIFPVBQESA-N
XLogP1.50
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone?
The IUPAC name of cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone (CID 45115989) is cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone.
What is the SMILES notation for cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone?
The canonical SMILES for cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone is O=C(C1CCCC1)[C@@H]1CCCN1.
What is the InChIKey of cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone?
The InChIKey is PAYGTTPEIKDFGU-VIFPVBQESA-N. The full InChI is InChI=1S/C10H17NO/c12-10(8-4-1-2-5-8)9-6-3-7-11-9/h8-9,11H,1-7H2/t9-/m0/s1.
What are the key properties of cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone?
cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone has a molecular weight of 167.25 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[(2S)-pyrrolidin-2-yl]methanone is sourced from PubChem (CID 45115989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).