2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide

C23H28N2O2 — CID 55865284

IUPAC2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide
SMILESCc1ccc(C(=O)C2CCN(C(C)C(=O)Nc3cccc(C)c3)CC2)cc1
InChIInChI=1S/C23H28N2O2/c1-16-7-9-19(10-8-16)22(26)20-11-13-25(14-12-20)18(3)23(27)24-21-6-4-5-17(2)15-21/h4-10,15,18,20H,11-14H2,1-3H3,(H,24,27)
InChIKeyBBANMRGAYWVVLK-UHFFFAOYSA-N
MW364.49 g/mol
LogP4.23
Rot. Bonds5

About 2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide

2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide (PubChem CID 55865284) has the molecular formula C23H28N2O2 and a molecular weight of 364.49 g/mol. Its IUPAC name is 2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide.

Molecular Properties

Compound Name2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide
PubChem CID55865284
Molecular FormulaC23H28N2O2
Molecular Weight364.49 g/mol
Exact Mass364.22
IUPAC Name2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide
SMILESCc1ccc(C(=O)C2CCN(C(C)C(=O)Nc3cccc(C)c3)CC2)cc1
InChIInChI=1S/C23H28N2O2/c1-16-7-9-19(10-8-16)22(26)20-11-13-25(14-12-20)18(3)23(27)24-21-6-4-5-17(2)15-21/h4-10,15,18,20H,11-14H2,1-3H3,(H,24,27)
InChIKeyBBANMRGAYWVVLK-UHFFFAOYSA-N
XLogP4.23
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-dimethylphenyl)-2-[4-(4-methylbenzoyl)piperidin-1-yl]propanamide
CID 3223551
N-(2,5-dimethylphenyl)-2-[4-(4-methylbenzoyl)piperidin-1-yl]propanamide
CID 55865034
2-(4-benzoylpiperidin-1-yl)-N-(3,4-dimethoxyphenyl)propanamide
CID 51322952
2-[4-(benzenesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)propanamide
CID 55482564
2-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidin-1-yl]-N-(3-methoxyphenyl)propanamide
CID 43054461
N-(4-methylphenyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]propanamide
CID 42927379
N-(2,6-dimethylphenyl)-2-[4-(4-methoxybenzoyl)piperidin-1-yl]propanamide
CID 55501519
2-(4-benzoylpiperidin-1-yl)-N-(4-cyanophenyl)propanamide
CID 17444836
(2R)-N-(3-methylphenyl)-2-[4-(2-pyrazol-1-ylethyl)piperidin-1-yl]propanamide
CID 125175137
2-[4-(2-hydroxyphenyl)piperazin-1-yl]-N-(3-methylphenyl)propanamide
CID 4877630
N-(3-acetamidophenyl)-2-(4-methylpiperidin-1-yl)propanamide
CID 86918794
1-(1-anilino-1-oxopropan-2-yl)-N-phenylpiperidine-4-carboxamide
CID 46615473

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide?
The IUPAC name of 2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide (CID 55865284) is 2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide.
What is the SMILES notation for 2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide?
The canonical SMILES for 2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide is Cc1ccc(C(=O)C2CCN(C(C)C(=O)Nc3cccc(C)c3)CC2)cc1.
What is the InChIKey of 2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide?
The InChIKey is BBANMRGAYWVVLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O2/c1-16-7-9-19(10-8-16)22(26)20-11-13-25(14-12-20)18(3)23(27)24-21-6-4-5-17(2)15-21/h4-10,15,18,20H,11-14H2,1-3H3,(H,24,27).
What are the key properties of 2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide?
2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide has a molecular weight of 364.49 g/mol, XLogP of 4.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-methylbenzoyl)piperidin-1-yl]-N-(3-methylphenyl)propanamide is sourced from PubChem (CID 55865284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).