azetidin-1-yl(cyclopenten-1-yl)methanone

C9H13NO — CID 126994970

IUPACazetidin-1-yl(cyclopenten-1-yl)methanone
SMILESO=C(C1=CCCC1)N1CCC1
InChIInChI=1S/C9H13NO/c11-9(10-6-3-7-10)8-4-1-2-5-8/h4H,1-3,5-7H2
InChIKeyMEADPJMOIQETNO-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.33
Rot. Bonds1

About azetidin-1-yl(cyclopenten-1-yl)methanone

azetidin-1-yl(cyclopenten-1-yl)methanone (PubChem CID 126994970) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is azetidin-1-yl(cyclopenten-1-yl)methanone.

Molecular Properties

Compound Nameazetidin-1-yl(cyclopenten-1-yl)methanone
PubChem CID126994970
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Nameazetidin-1-yl(cyclopenten-1-yl)methanone
SMILESO=C(C1=CCCC1)N1CCC1
InChIInChI=1S/C9H13NO/c11-9(10-6-3-7-10)8-4-1-2-5-8/h4H,1-3,5-7H2
InChIKeyMEADPJMOIQETNO-UHFFFAOYSA-N
XLogP1.33
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of azetidin-1-yl(cyclopenten-1-yl)methanone?
The IUPAC name of azetidin-1-yl(cyclopenten-1-yl)methanone (CID 126994970) is azetidin-1-yl(cyclopenten-1-yl)methanone.
What is the SMILES notation for azetidin-1-yl(cyclopenten-1-yl)methanone?
The canonical SMILES for azetidin-1-yl(cyclopenten-1-yl)methanone is O=C(C1=CCCC1)N1CCC1.
What is the InChIKey of azetidin-1-yl(cyclopenten-1-yl)methanone?
The InChIKey is MEADPJMOIQETNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c11-9(10-6-3-7-10)8-4-1-2-5-8/h4H,1-3,5-7H2.
What are the key properties of azetidin-1-yl(cyclopenten-1-yl)methanone?
azetidin-1-yl(cyclopenten-1-yl)methanone has a molecular weight of 151.21 g/mol, XLogP of 1.33, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-1-yl(cyclopenten-1-yl)methanone is sourced from PubChem (CID 126994970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).