N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide

C21H21F3N2O2 — CID 27224348

IUPACN-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC[C@@H](C(F)(F)F)C1)Nc1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C21H21F3N2O2/c22-21(23,24)16-9-6-12-26(13-16)14-19(27)25-18-11-5-4-10-17(18)20(28)15-7-2-1-3-8-15/h1-5,7-8,10-11,16H,6,9,12-14H2,(H,25,27)/t16-/m1/s1
InChIKeyZSFVGQNKKONSEJ-MRXNPFEDSA-N
MW390.41 g/mol
LogP4.13
Rot. Bonds5

About N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide

N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide (PubChem CID 27224348) has the molecular formula C21H21F3N2O2 and a molecular weight of 390.41 g/mol. Its IUPAC name is N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide
PubChem CID27224348
Molecular FormulaC21H21F3N2O2
Molecular Weight390.41 g/mol
Exact Mass390.16
IUPAC NameN-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC[C@@H](C(F)(F)F)C1)Nc1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C21H21F3N2O2/c22-21(23,24)16-9-6-12-26(13-16)14-19(27)25-18-11-5-4-10-17(18)20(28)15-7-2-1-3-8-15/h1-5,7-8,10-11,16H,6,9,12-14H2,(H,25,27)/t16-/m1/s1
InChIKeyZSFVGQNKKONSEJ-MRXNPFEDSA-N
XLogP4.13
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.41
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dichlorophenyl)-2-[3-(trifluoromethyl)piperidin-1-yl]acetamide
CID 46801707
N-(5-chloro-2-fluorophenyl)-2-[3-(trifluoromethyl)piperidin-1-yl]acetamide
CID 46801664
N-(2,1,3-benzothiadiazol-4-yl)-2-[3-(trifluoromethyl)piperidin-1-yl]acetamide
CID 46801631
N-(2-methoxyphenyl)-4-[[2-[3-(trifluoromethyl)piperidin-1-yl]acetyl]amino]benzamide
CID 46801583
N-[2-(2-chloroanilino)-2-oxoethyl]-N-methyl-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide
CID 27098428
N-(3,4-dichlorophenyl)-2-[3-(trifluoromethyl)piperidin-1-yl]acetamide
CID 171691104
N-(1-benzylpiperidin-4-yl)-2-[3-(trifluoromethyl)piperidin-1-yl]acetamide
CID 45281619
N,N-dimethyl-4-[[2-[(3S)-3-(trifluoromethyl)piperidin-1-yl]acetyl]amino]benzamide
CID 27223796
N-[1-[2-(2-benzoylanilino)-2-oxoethyl]piperidin-4-yl]-4-fluorobenzamide
CID 34791543
2-[[2-(3-methylpiperidin-1-yl)acetyl]amino]benzamide
CID 22197772
N-(2-fluorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119919928
N-(2-benzoyl-4-methylphenyl)-2-piperidin-1-ylacetamide
CID 1360092

Frequently Asked Questions

What is the IUPAC name of N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide (CID 27224348) is N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide is O=C(CN1CCC[C@@H](C(F)(F)F)C1)Nc1ccccc1C(=O)c1ccccc1.
What is the InChIKey of N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide?
The InChIKey is ZSFVGQNKKONSEJ-MRXNPFEDSA-N. The full InChI is InChI=1S/C21H21F3N2O2/c22-21(23,24)16-9-6-12-26(13-16)14-19(27)25-18-11-5-4-10-17(18)20(28)15-7-2-1-3-8-15/h1-5,7-8,10-11,16H,6,9,12-14H2,(H,25,27)/t16-/m1/s1.
What are the key properties of N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide?
N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide has a molecular weight of 390.41 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzoylphenyl)-2-[(3R)-3-(trifluoromethyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 27224348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).