2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide

C21H25N3O3 — CID 78809748

IUPAC2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2C(=O)NC2CCN(C)CC2)cc1
InChIInChI=1S/C21H25N3O3/c1-24-13-11-16(12-14-24)22-21(26)18-5-3-4-6-19(18)23-20(25)15-7-9-17(27-2)10-8-15/h3-10,16H,11-14H2,1-2H3,(H,22,26)(H,23,25)
InChIKeyRIUBIOADKCUHCA-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.77
Rot. Bonds5

About 2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide

2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide (PubChem CID 78809748) has the molecular formula C21H25N3O3 and a molecular weight of 367.45 g/mol. Its IUPAC name is 2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide
PubChem CID78809748
Molecular FormulaC21H25N3O3
Molecular Weight367.45 g/mol
Exact Mass367.19
IUPAC Name2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2C(=O)NC2CCN(C)CC2)cc1
InChIInChI=1S/C21H25N3O3/c1-24-13-11-16(12-14-24)22-21(26)18-5-3-4-6-19(18)23-20(25)15-7-9-17(27-2)10-8-15/h3-10,16H,11-14H2,1-2H3,(H,22,26)(H,23,25)
InChIKeyRIUBIOADKCUHCA-UHFFFAOYSA-N
XLogP2.77
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-methoxybenzoyl)amino]benzoic acid
CID 721421
methyl 4-[[2-(cyclohexylcarbamoyl)phenyl]carbamoyl]benzoate
CID 17178227
N-cyclopropyl-2-[(4-fluorobenzoyl)amino]benzamide
CID 2681136
N-(2-acetylphenyl)-4-methoxybenzamide
CID 3509429
N-[2-(3-anilinopyrrolidine-1-carbonyl)phenyl]-4-methoxybenzamide
CID 56504081
4-methoxy-N-[2-(piperazine-1-carbonyl)phenyl]benzamide
CID 119403655
2-[(4-bromobenzoyl)amino]-N-cyclopropylbenzamide
CID 7729400
4-methoxy-N-[2-[3-(methylamino)piperidine-1-carbonyl]phenyl]benzamide
CID 119493451
2-(4-methoxyanilino)-N-[1-(2-methylpropanoyl)piperidin-4-yl]benzamide
CID 55718269
N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
CID 3218434
N-[2-(cyclohexylcarbamoyl)phenyl]-1-methylpiperidine-4-carboxamide
CID 99970623
N-[1-(2-bromobenzoyl)piperidin-4-yl]-4-methoxybenzamide
CID 108548886

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide?
The IUPAC name of 2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide (CID 78809748) is 2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide.
What is the SMILES notation for 2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide?
The canonical SMILES for 2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide is COc1ccc(C(=O)Nc2ccccc2C(=O)NC2CCN(C)CC2)cc1.
What is the InChIKey of 2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide?
The InChIKey is RIUBIOADKCUHCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O3/c1-24-13-11-16(12-14-24)22-21(26)18-5-3-4-6-19(18)23-20(25)15-7-9-17(27-2)10-8-15/h3-10,16H,11-14H2,1-2H3,(H,22,26)(H,23,25).
What are the key properties of 2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide?
2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide has a molecular weight of 367.45 g/mol, XLogP of 2.77, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxybenzoyl)amino]-N-(1-methylpiperidin-4-yl)benzamide is sourced from PubChem (CID 78809748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).