4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide

C23H28N2O2 — CID 45196763

IUPAC4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide
SMILESCC(=O)c1ccc(C(=O)N(C)C2CCCN(CCc3ccccc3)C2)cc1
InChIInChI=1S/C23H28N2O2/c1-18(26)20-10-12-21(13-11-20)23(27)24(2)22-9-6-15-25(17-22)16-14-19-7-4-3-5-8-19/h3-5,7-8,10-13,22H,6,9,14-17H2,1-2H3
InChIKeyCBOUHSBNVLIMDE-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.67
Rot. Bonds6

About 4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide

4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide (PubChem CID 45196763) has the molecular formula C23H28N2O2 and a molecular weight of 364.49 g/mol. Its IUPAC name is 4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide.

Molecular Properties

Compound Name4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide
PubChem CID45196763
Molecular FormulaC23H28N2O2
Molecular Weight364.49 g/mol
Exact Mass364.22
IUPAC Name4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide
SMILESCC(=O)c1ccc(C(=O)N(C)C2CCCN(CCc3ccccc3)C2)cc1
InChIInChI=1S/C23H28N2O2/c1-18(26)20-10-12-21(13-11-20)23(27)24(2)22-9-6-15-25(17-22)16-14-19-7-4-3-5-8-19/h3-5,7-8,10-13,22H,6,9,14-17H2,1-2H3
InChIKeyCBOUHSBNVLIMDE-UHFFFAOYSA-N
XLogP3.67
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]pyridine-4-carboxamide
CID 45230724
5-acetyl-N-methyl-N-[(3S)-1-(2-phenylethyl)piperidin-3-yl]thiophene-3-carboxamide
CID 25383007
N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]cyclopentene-1-carboxamide
CID 45191222
N-methyl-3-(2-oxoimidazolidin-1-yl)-N-[(3R)-1-(2-phenylethyl)piperidin-3-yl]benzamide
CID 25369030
1-ethyl-N-methyl-N-[(3S)-1-(3-phenylpropyl)piperidin-3-yl]pyrazole-4-carboxamide
CID 42510266
4-(4-methoxyphenyl)-N-methyl-4-oxo-N-[(3R)-1-(2-phenylethyl)piperidin-3-yl]butanamide
CID 26319728
methyl 3-[methyl-[(3R)-1-(3-phenylpropyl)piperidin-3-yl]carbamoyl]benzoate
CID 42245037
N-methyl-N-(1-methylpiperidin-4-yl)-4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzamide
CID 26328291
2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide
CID 56715324
N-methyl-N-[(3R)-1-(3-phenylpropyl)piperidin-3-yl]pyrazine-2-carboxamide
CID 42346476
N,4-dimethyl-2-(methylamino)-N-[1-(2-phenylethyl)piperidin-3-yl]-1,3-thiazole-5-carboxamide
CID 45183595
N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]-2-pyridin-2-ylsulfanylacetamide
CID 45239167

Frequently Asked Questions

What is the IUPAC name of 4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide?
The IUPAC name of 4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide (CID 45196763) is 4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide.
What is the SMILES notation for 4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide?
The canonical SMILES for 4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide is CC(=O)c1ccc(C(=O)N(C)C2CCCN(CCc3ccccc3)C2)cc1.
What is the InChIKey of 4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide?
The InChIKey is CBOUHSBNVLIMDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O2/c1-18(26)20-10-12-21(13-11-20)23(27)24(2)22-9-6-15-25(17-22)16-14-19-7-4-3-5-8-19/h3-5,7-8,10-13,22H,6,9,14-17H2,1-2H3.
What are the key properties of 4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide?
4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide has a molecular weight of 364.49 g/mol, XLogP of 3.67, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetyl-N-methyl-N-[1-(2-phenylethyl)piperidin-3-yl]benzamide is sourced from PubChem (CID 45196763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).