N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide

C20H22F2N2O — CID 46047957

IUPACN-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide
SMILESCC(=O)N(c1ccc(F)cc1)C1CCN(Cc2cccc(F)c2)CC1
InChIInChI=1S/C20H22F2N2O/c1-15(25)24(19-7-5-17(21)6-8-19)20-9-11-23(12-10-20)14-16-3-2-4-18(22)13-16/h2-8,13,20H,9-12,14H2,1H3
InChIKeyHXZZQSZRFXIICL-UHFFFAOYSA-N
MW344.41 g/mol
LogP3.98
Rot. Bonds4

About N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide

N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide (PubChem CID 46047957) has the molecular formula C20H22F2N2O and a molecular weight of 344.41 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide
PubChem CID46047957
Molecular FormulaC20H22F2N2O
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC NameN-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide
SMILESCC(=O)N(c1ccc(F)cc1)C1CCN(Cc2cccc(F)c2)CC1
InChIInChI=1S/C20H22F2N2O/c1-15(25)24(19-7-5-17(21)6-8-19)20-9-11-23(12-10-20)14-16-3-2-4-18(22)13-16/h2-8,13,20H,9-12,14H2,1H3
InChIKeyHXZZQSZRFXIICL-UHFFFAOYSA-N
XLogP3.98
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide?
The IUPAC name of N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide (CID 46047957) is N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide?
The canonical SMILES for N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide is CC(=O)N(c1ccc(F)cc1)C1CCN(Cc2cccc(F)c2)CC1.
What is the InChIKey of N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide?
The InChIKey is HXZZQSZRFXIICL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22F2N2O/c1-15(25)24(19-7-5-17(21)6-8-19)20-9-11-23(12-10-20)14-16-3-2-4-18(22)13-16/h2-8,13,20H,9-12,14H2,1H3.
What are the key properties of N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide?
N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide has a molecular weight of 344.41 g/mol, XLogP of 3.98, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 46047957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).