N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide

C21H23FN2O3 — CID 24761956

IUPACN-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide
SMILESCOc1ccc(C(=O)C2CCN(CC(=O)Nc3ccccc3F)CC2)cc1
InChIInChI=1S/C21H23FN2O3/c1-27-17-8-6-15(7-9-17)21(26)16-10-12-24(13-11-16)14-20(25)23-19-5-3-2-4-18(19)22/h2-9,16H,10-14H2,1H3,(H,23,25)
InChIKeyDLTUDVQWPQMRDV-UHFFFAOYSA-N
MW370.42 g/mol
LogP3.37
Rot. Bonds6

About N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide

N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide (PubChem CID 24761956) has the molecular formula C21H23FN2O3 and a molecular weight of 370.42 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide
PubChem CID24761956
Molecular FormulaC21H23FN2O3
Molecular Weight370.42 g/mol
Exact Mass370.17
IUPAC NameN-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide
SMILESCOc1ccc(C(=O)C2CCN(CC(=O)Nc3ccccc3F)CC2)cc1
InChIInChI=1S/C21H23FN2O3/c1-27-17-8-6-15(7-9-17)21(26)16-10-12-24(13-11-16)14-20(25)23-19-5-3-2-4-18(19)22/h2-9,16H,10-14H2,1H3,(H,23,25)
InChIKeyDLTUDVQWPQMRDV-UHFFFAOYSA-N
XLogP3.37
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.42
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide (CID 24761956) is N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide is COc1ccc(C(=O)C2CCN(CC(=O)Nc3ccccc3F)CC2)cc1.
What is the InChIKey of N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide?
The InChIKey is DLTUDVQWPQMRDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23FN2O3/c1-27-17-8-6-15(7-9-17)21(26)16-10-12-24(13-11-16)14-20(25)23-19-5-3-2-4-18(19)22/h2-9,16H,10-14H2,1H3,(H,23,25).
What are the key properties of N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide?
N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide has a molecular weight of 370.42 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 24761956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).