N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide

C23H28ClN3O2 — CID 56569861

IUPACN-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide
SMILESCC(C)NC1CCN(CC(=O)Nc2ccc(Cl)cc2C(=O)c2ccccc2)CC1
InChIInChI=1S/C23H28ClN3O2/c1-16(2)25-19-10-12-27(13-11-19)15-22(28)26-21-9-8-18(24)14-20(21)23(29)17-6-4-3-5-7-17/h3-9,14,16,19,25H,10-13,15H2,1-2H3,(H,26,28)
InChIKeyGOLJKSUWSMVUAI-UHFFFAOYSA-N
MW413.95 g/mol
LogP3.97
Rot. Bonds7

About N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide

N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide (PubChem CID 56569861) has the molecular formula C23H28ClN3O2 and a molecular weight of 413.95 g/mol. Its IUPAC name is N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide
PubChem CID56569861
Molecular FormulaC23H28ClN3O2
Molecular Weight413.95 g/mol
Exact Mass413.19
IUPAC NameN-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide
SMILESCC(C)NC1CCN(CC(=O)Nc2ccc(Cl)cc2C(=O)c2ccccc2)CC1
InChIInChI=1S/C23H28ClN3O2/c1-16(2)25-19-10-12-27(13-11-19)15-22(28)26-21-9-8-18(24)14-20(21)23(29)17-6-4-3-5-7-17/h3-9,14,16,19,25H,10-13,15H2,1-2H3,(H,26,28)
InChIKeyGOLJKSUWSMVUAI-UHFFFAOYSA-N
XLogP3.97
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.95
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide 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-benzoyl-4-chlorophenyl)-2-piperidin-1-ylacetamide;hydrochloride
CID 3039234
N-(2-benzoyl-4-chlorophenyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 100774842
N-(2-benzoyl-4-chlorophenyl)-2-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]acetamide
CID 56501325
[2-(2-benzoyl-4-chloroanilino)-2-oxoethyl] 2-methylpropanoate
CID 7782592
N-(2-benzoyl-4-methylphenyl)-2-piperidin-1-ylacetamide
CID 1360092
N-(2-benzoyl-4-chlorophenyl)-2-iodoacetamide
CID 12500538
N-(2-benzoyl-4-chlorophenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 7940762
[2-(2-benzoyl-4-chloroanilino)-2-oxoethyl]-diethylazanium
CID 5113102
[5-chloro-2-(cyclopropylamino)phenyl]-phenylmethanone
CID 14598884
N-[1-[2-(2-benzoylanilino)-2-oxoethyl]piperidin-4-yl]-4-fluorobenzamide
CID 34791543
N-(2-benzoyl-4-chlorophenyl)-2-[[(1R)-1-[(1S,2S,4R)-2-bicyclo[2.2.1]heptanyl]ethyl]amino]acetamide
CID 2355286
N-(2-benzoyl-4-chlorophenyl)-2-[4-[7-[(4-chlorophenyl)methyl]-1,3-dimethyl-2,6-dioxopurin-8-yl]piperazin-1-yl]acetamide
CID 17071891

Frequently Asked Questions

What is the IUPAC name of N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide?
The IUPAC name of N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide (CID 56569861) is N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide?
The canonical SMILES for N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide is CC(C)NC1CCN(CC(=O)Nc2ccc(Cl)cc2C(=O)c2ccccc2)CC1.
What is the InChIKey of N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide?
The InChIKey is GOLJKSUWSMVUAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28ClN3O2/c1-16(2)25-19-10-12-27(13-11-19)15-22(28)26-21-9-8-18(24)14-20(21)23(29)17-6-4-3-5-7-17/h3-9,14,16,19,25H,10-13,15H2,1-2H3,(H,26,28).
What are the key properties of N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide?
N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide has a molecular weight of 413.95 g/mol, XLogP of 3.97, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzoyl-4-chlorophenyl)-2-[4-(propan-2-ylamino)piperidin-1-yl]acetamide is sourced from PubChem (CID 56569861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).