cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone

C10H13NO — CID 89023366

IUPACcyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone
SMILESO=C(C1=CCCC1)N1C=CCC1
InChIInChI=1S/C10H13NO/c12-10(9-5-1-2-6-9)11-7-3-4-8-11/h3,5,7H,1-2,4,6,8H2
InChIKeyQHZWDSMQSADIBS-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.84
Rot. Bonds1

About cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone

cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone (PubChem CID 89023366) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone.

Molecular Properties

Compound Namecyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone
PubChem CID89023366
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Namecyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone
SMILESO=C(C1=CCCC1)N1C=CCC1
InChIInChI=1S/C10H13NO/c12-10(9-5-1-2-6-9)11-7-3-4-8-11/h3,5,7H,1-2,4,6,8H2
InChIKeyQHZWDSMQSADIBS-UHFFFAOYSA-N
XLogP1.84
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone?
The IUPAC name of cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone (CID 89023366) is cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone.
What is the SMILES notation for cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone?
The canonical SMILES for cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone is O=C(C1=CCCC1)N1C=CCC1.
What is the InChIKey of cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone?
The InChIKey is QHZWDSMQSADIBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c12-10(9-5-1-2-6-9)11-7-3-4-8-11/h3,5,7H,1-2,4,6,8H2.
What are the key properties of cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone?
cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone has a molecular weight of 163.22 g/mol, XLogP of 1.84, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenten-1-yl(2,3-dihydropyrrol-1-yl)methanone is sourced from PubChem (CID 89023366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).