N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide

C20H20ClFN2O2 — CID 1437944

IUPACN-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(C(=O)c2ccc(F)cc2)CC1)Nc1ccccc1Cl
InChIInChI=1S/C20H20ClFN2O2/c21-17-3-1-2-4-18(17)23-19(25)13-24-11-9-15(10-12-24)20(26)14-5-7-16(22)8-6-14/h1-8,15H,9-13H2,(H,23,25)
InChIKeyXSNZXCAZXFADAF-UHFFFAOYSA-N
MW374.84 g/mol
LogP4.01
Rot. Bonds5

About N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide

N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide (PubChem CID 1437944) has the molecular formula C20H20ClFN2O2 and a molecular weight of 374.84 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide
PubChem CID1437944
Molecular FormulaC20H20ClFN2O2
Molecular Weight374.84 g/mol
Exact Mass374.12
IUPAC NameN-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(C(=O)c2ccc(F)cc2)CC1)Nc1ccccc1Cl
InChIInChI=1S/C20H20ClFN2O2/c21-17-3-1-2-4-18(17)23-19(25)13-24-11-9-15(10-12-24)20(26)14-5-7-16(22)8-6-14/h1-8,15H,9-13H2,(H,23,25)
InChIKeyXSNZXCAZXFADAF-UHFFFAOYSA-N
XLogP4.01
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.84
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide (CID 1437944) is N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide is O=C(CN1CCC(C(=O)c2ccc(F)cc2)CC1)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide?
The InChIKey is XSNZXCAZXFADAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20ClFN2O2/c21-17-3-1-2-4-18(17)23-19(25)13-24-11-9-15(10-12-24)20(26)14-5-7-16(22)8-6-14/h1-8,15H,9-13H2,(H,23,25).
What are the key properties of N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide?
N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide has a molecular weight of 374.84 g/mol, XLogP of 4.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 1437944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).