3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide

C21H24ClN3O2 — CID 55876842

IUPAC3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide
SMILESCC(=O)NC(CC(=O)Nc1cccc(N2CCCC2)c1)c1ccc(Cl)cc1
InChIInChI=1S/C21H24ClN3O2/c1-15(26)23-20(16-7-9-17(22)10-8-16)14-21(27)24-18-5-4-6-19(13-18)25-11-2-3-12-25/h4-10,13,20H,2-3,11-12,14H2,1H3,(H,23,26)(H,24,27)
InChIKeyFINJFXDUYVUBTD-UHFFFAOYSA-N
MW385.90 g/mol
LogP4.15
Rot. Bonds6

About 3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide

3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide (PubChem CID 55876842) has the molecular formula C21H24ClN3O2 and a molecular weight of 385.90 g/mol. Its IUPAC name is 3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide.

Molecular Properties

Compound Name3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide
PubChem CID55876842
Molecular FormulaC21H24ClN3O2
Molecular Weight385.90 g/mol
Exact Mass385.16
IUPAC Name3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide
SMILESCC(=O)NC(CC(=O)Nc1cccc(N2CCCC2)c1)c1ccc(Cl)cc1
InChIInChI=1S/C21H24ClN3O2/c1-15(26)23-20(16-7-9-17(22)10-8-16)14-21(27)24-18-5-4-6-19(13-18)25-11-2-3-12-25/h4-10,13,20H,2-3,11-12,14H2,1H3,(H,23,26)(H,24,27)
InChIKeyFINJFXDUYVUBTD-UHFFFAOYSA-N
XLogP4.15
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.90
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide 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

3-[[3-acetamido-3-(4-chlorophenyl)propanoyl]amino]-N-methylbenzamide
CID 46585410
3-acetamido-3-(4-chlorophenyl)-N-(3-cyanophenyl)propanamide
CID 51195259
3-acetamido-3-(4-chlorophenyl)-N-[3-methyl-4-(4-methylpiperazin-1-yl)phenyl]propanamide
CID 55492554
3-acetamido-3-(4-chlorophenyl)-N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)propanamide
CID 49169432
3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide
CID 51271181
3-(4-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)butanamide
CID 110618601
2-chloro-N-(3-piperidin-1-ylphenyl)acetamide
CID 43822445
3-acetamido-3-(4-chlorophenyl)-N-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]propanamide
CID 55493282
2-(methylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 54862520
4-amino-N-[3-(azepan-1-yl)phenyl]pentanamide
CID 120565751
3-acetamido-3-(4-chlorophenyl)-N-(4-methoxyphenyl)propanamide
CID 46689011
3-acetamido-N-(3-piperidin-1-ylphenyl)propanamide
CID 110426221

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide?
The IUPAC name of 3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide (CID 55876842) is 3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide.
What is the SMILES notation for 3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide?
The canonical SMILES for 3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide is CC(=O)NC(CC(=O)Nc1cccc(N2CCCC2)c1)c1ccc(Cl)cc1.
What is the InChIKey of 3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide?
The InChIKey is FINJFXDUYVUBTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24ClN3O2/c1-15(26)23-20(16-7-9-17(22)10-8-16)14-21(27)24-18-5-4-6-19(13-18)25-11-2-3-12-25/h4-10,13,20H,2-3,11-12,14H2,1H3,(H,23,26)(H,24,27).
What are the key properties of 3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide?
3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide has a molecular weight of 385.90 g/mol, XLogP of 4.15, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide is sourced from PubChem (CID 55876842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).