cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone

C12H18FNO — CID 126791044

IUPACcyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone
SMILESO=C(C1=CCCC1)N1CCC(CF)CC1
InChIInChI=1S/C12H18FNO/c13-9-10-5-7-14(8-6-10)12(15)11-3-1-2-4-11/h3,10H,1-2,4-9H2
InChIKeyHOONHSLTFVKFHE-UHFFFAOYSA-N
MW211.28 g/mol
LogP2.30
Rot. Bonds2

About cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone

cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone (PubChem CID 126791044) has the molecular formula C12H18FNO and a molecular weight of 211.28 g/mol. Its IUPAC name is cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone
PubChem CID126791044
Molecular FormulaC12H18FNO
Molecular Weight211.28 g/mol
Exact Mass211.14
IUPAC Namecyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone
SMILESO=C(C1=CCCC1)N1CCC(CF)CC1
InChIInChI=1S/C12H18FNO/c13-9-10-5-7-14(8-6-10)12(15)11-3-1-2-4-11/h3,10H,1-2,4-9H2
InChIKeyHOONHSLTFVKFHE-UHFFFAOYSA-N
XLogP2.30
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.28
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone?
The IUPAC name of cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone (CID 126791044) is cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone.
What is the SMILES notation for cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone?
The canonical SMILES for cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone is O=C(C1=CCCC1)N1CCC(CF)CC1.
What is the InChIKey of cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone?
The InChIKey is HOONHSLTFVKFHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18FNO/c13-9-10-5-7-14(8-6-10)12(15)11-3-1-2-4-11/h3,10H,1-2,4-9H2.
What are the key properties of cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone?
cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone has a molecular weight of 211.28 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenten-1-yl-[4-(fluoromethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 126791044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).