N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide

C22H26N2O2 — CID 46378988

IUPACN-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide
SMILESCc1ccccc1C(=O)NCCC1CCN(C(=O)c2ccccc2)CC1
InChIInChI=1S/C22H26N2O2/c1-17-7-5-6-10-20(17)21(25)23-14-11-18-12-15-24(16-13-18)22(26)19-8-3-2-4-9-19/h2-10,18H,11-16H2,1H3,(H,23,25)
InChIKeySKYDUEQLBGEPAP-UHFFFAOYSA-N
MW350.46 g/mol
LogP3.67
Rot. Bonds5

About N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide

N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide (PubChem CID 46378988) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide
PubChem CID46378988
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide
SMILESCc1ccccc1C(=O)NCCC1CCN(C(=O)c2ccccc2)CC1
InChIInChI=1S/C22H26N2O2/c1-17-7-5-6-10-20(17)21(25)23-14-11-18-12-15-24(16-13-18)22(26)19-8-3-2-4-9-19/h2-10,18H,11-16H2,1H3,(H,23,25)
InChIKeySKYDUEQLBGEPAP-UHFFFAOYSA-N
XLogP3.67
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(1-benzoylpiperidin-4-yl)ethyl]-3-methylbenzamide
CID 46378991
N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2,2-dimethylpropanamide
CID 46378993
N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzenesulfonamide
CID 53103847
N-[2-(1-benzoylpiperidin-4-yl)ethyl]pentanamide
CID 46379006
2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide
CID 39512672
N-[(1-acetylpiperidin-4-yl)methyl]-2-methylbenzamide
CID 110736135
N-[(1R)-1-(1-benzoylpiperidin-4-yl)-2-(2-methoxyethylamino)-2-oxoethyl]-2-methylbenzamide
CID 93196580
N-(2-cyclopropylethyl)-2-iodo-3-methylbenzamide
CID 103708603
2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide
CID 70845742
[4-[2-(azetidin-3-yl)ethyl]piperidin-1-yl]-phenylmethanone
CID 90953914
[4-(methylaminomethyl)piperidin-1-yl]-phenylmethanone
CID 22983162
2-(2-cyclobutylethylcarbamoyl)benzoic acid
CID 113478591

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide?
The IUPAC name of N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide (CID 46378988) is N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide.
What is the SMILES notation for N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide?
The canonical SMILES for N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide is Cc1ccccc1C(=O)NCCC1CCN(C(=O)c2ccccc2)CC1.
What is the InChIKey of N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide?
The InChIKey is SKYDUEQLBGEPAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-17-7-5-6-10-20(17)21(25)23-14-11-18-12-15-24(16-13-18)22(26)19-8-3-2-4-9-19/h2-10,18H,11-16H2,1H3,(H,23,25).
What are the key properties of N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide?
N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide has a molecular weight of 350.46 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide is sourced from PubChem (CID 46378988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).