2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide

C14H19FN2O — CID 47344420

IUPAC2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide
SMILESCN1CCCC(NC(=O)Cc2ccccc2F)C1
InChIInChI=1S/C14H19FN2O/c1-17-8-4-6-12(10-17)16-14(18)9-11-5-2-3-7-13(11)15/h2-3,5,7,12H,4,6,8-10H2,1H3,(H,16,18)
InChIKeyIMPWMNCRDMDWQB-UHFFFAOYSA-N
MW250.32 g/mol
LogP1.58
Rot. Bonds3

About 2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide

2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide (PubChem CID 47344420) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide
PubChem CID47344420
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC Name2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide
SMILESCN1CCCC(NC(=O)Cc2ccccc2F)C1
InChIInChI=1S/C14H19FN2O/c1-17-8-4-6-12(10-17)16-14(18)9-11-5-2-3-7-13(11)15/h2-3,5,7,12H,4,6,8-10H2,1H3,(H,16,18)
InChIKeyIMPWMNCRDMDWQB-UHFFFAOYSA-N
XLogP1.58
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide (CID 47344420) is 2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide is CN1CCCC(NC(=O)Cc2ccccc2F)C1.
What is the InChIKey of 2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide?
The InChIKey is IMPWMNCRDMDWQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c1-17-8-4-6-12(10-17)16-14(18)9-11-5-2-3-7-13(11)15/h2-3,5,7,12H,4,6,8-10H2,1H3,(H,16,18).
What are the key properties of 2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide?
2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide has a molecular weight of 250.32 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-(1-methylpiperidin-3-yl)acetamide is sourced from PubChem (CID 47344420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).