4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide

C23H29N3O3 — CID 91913285

IUPAC4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide
SMILESCOc1ccccc1C(=O)NCCC1CCN(C(=O)Nc2ccc(C)cc2)CC1
InChIInChI=1S/C23H29N3O3/c1-17-7-9-19(10-8-17)25-23(28)26-15-12-18(13-16-26)11-14-24-22(27)20-5-3-4-6-21(20)29-2/h3-10,18H,11-16H2,1-2H3,(H,24,27)(H,25,28)
InChIKeyRHWUVEHAFMCYLY-UHFFFAOYSA-N
MW395.50 g/mol
LogP4.07
Rot. Bonds6

About 4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide

4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide (PubChem CID 91913285) has the molecular formula C23H29N3O3 and a molecular weight of 395.50 g/mol. Its IUPAC name is 4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide
PubChem CID91913285
Molecular FormulaC23H29N3O3
Molecular Weight395.50 g/mol
Exact Mass395.22
IUPAC Name4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide
SMILESCOc1ccccc1C(=O)NCCC1CCN(C(=O)Nc2ccc(C)cc2)CC1
InChIInChI=1S/C23H29N3O3/c1-17-7-9-19(10-8-17)25-23(28)26-15-12-18(13-16-26)11-14-24-22(27)20-5-3-4-6-21(20)29-2/h3-10,18H,11-16H2,1-2H3,(H,24,27)(H,25,28)
InChIKeyRHWUVEHAFMCYLY-UHFFFAOYSA-N
XLogP4.07
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.50
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
CID 99970994
N-(4-methylphenyl)-4-[2-(2-methylpropanoylamino)ethyl]piperidine-1-carboxamide
CID 91903591
4-[2-(cyclobutanecarbonylamino)ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide
CID 91913288
4-[2-(3-methoxypropanoylamino)ethyl]-N-phenylpiperidine-1-carboxamide
CID 91913194
4-[2-[(3,4-dimethoxybenzoyl)amino]ethyl]-N-(3-fluoro-4-methylphenyl)piperidine-1-carboxamide
CID 91913328
4-(methylaminomethyl)-N-(4-methylphenyl)piperidine-1-carboxamide
CID 63248764
4-[2-[[2-(3-methoxyphenyl)acetyl]amino]ethyl]-N-phenylpiperidine-1-carboxamide
CID 46381852
N-[2-[1-[(4-fluorophenyl)carbamoyl]piperidin-4-yl]ethyl]pyridine-2-carboxamide
CID 91913215
N-(3,5-difluorophenyl)-4-[2-[(3,4-dimethoxybenzoyl)amino]ethyl]piperidine-1-carboxamide
CID 91903691
2-methoxy-N-[[1-(4-methylphenyl)pyrrolidin-3-yl]methyl]benzamide
CID 110413741
N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide
CID 62665285
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate
CID 29353501

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide?
The IUPAC name of 4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide (CID 91913285) is 4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide?
The canonical SMILES for 4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide is COc1ccccc1C(=O)NCCC1CCN(C(=O)Nc2ccc(C)cc2)CC1.
What is the InChIKey of 4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide?
The InChIKey is RHWUVEHAFMCYLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O3/c1-17-7-9-19(10-8-17)25-23(28)26-15-12-18(13-16-26)11-14-24-22(27)20-5-3-4-6-21(20)29-2/h3-10,18H,11-16H2,1-2H3,(H,24,27)(H,25,28).
What are the key properties of 4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide?
4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide has a molecular weight of 395.50 g/mol, XLogP of 4.07, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 91913285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).