(2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone

C15H20FNO — CID 116569677

IUPAC(2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone
SMILESCCCC1(C(=O)c2ccccc2F)CCCNC1
InChIInChI=1S/C15H20FNO/c1-2-8-15(9-5-10-17-11-15)14(18)12-6-3-4-7-13(12)16/h3-4,6-7,17H,2,5,8-11H2,1H3
InChIKeyINDNNSFMUIWEJE-UHFFFAOYSA-N
MW249.33 g/mol
LogP3.18
Rot. Bonds4

About (2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone

(2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone (PubChem CID 116569677) has the molecular formula C15H20FNO and a molecular weight of 249.33 g/mol. Its IUPAC name is (2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone.

Molecular Properties

Compound Name(2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone
PubChem CID116569677
Molecular FormulaC15H20FNO
Molecular Weight249.33 g/mol
Exact Mass249.15
IUPAC Name(2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone
SMILESCCCC1(C(=O)c2ccccc2F)CCCNC1
InChIInChI=1S/C15H20FNO/c1-2-8-15(9-5-10-17-11-15)14(18)12-6-3-4-7-13(12)16/h3-4,6-7,17H,2,5,8-11H2,1H3
InChIKeyINDNNSFMUIWEJE-UHFFFAOYSA-N
XLogP3.18
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone?
The IUPAC name of (2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone (CID 116569677) is (2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone.
What is the SMILES notation for (2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone?
The canonical SMILES for (2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone is CCCC1(C(=O)c2ccccc2F)CCCNC1.
What is the InChIKey of (2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone?
The InChIKey is INDNNSFMUIWEJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO/c1-2-8-15(9-5-10-17-11-15)14(18)12-6-3-4-7-13(12)16/h3-4,6-7,17H,2,5,8-11H2,1H3.
What are the key properties of (2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone?
(2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone has a molecular weight of 249.33 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-(3-propylpiperidin-3-yl)methanone is sourced from PubChem (CID 116569677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).