2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide

C23H27N3O3 — CID 87030997

IUPAC2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(CC(=O)Nc2ccccc2C(=O)N2CCC(C)CC2)cc1
InChIInChI=1S/C23H27N3O3/c1-16-11-13-26(14-12-16)23(29)20-5-3-4-6-21(20)25-22(28)15-18-7-9-19(10-8-18)24-17(2)27/h3-10,16H,11-15H2,1-2H3,(H,24,27)(H,25,28)
InChIKeyGRPQKXDPJBWKPX-UHFFFAOYSA-N
MW393.49 g/mol
LogP3.70
Rot. Bonds5

About 2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide

2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide (PubChem CID 87030997) has the molecular formula C23H27N3O3 and a molecular weight of 393.49 g/mol. Its IUPAC name is 2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
PubChem CID87030997
Molecular FormulaC23H27N3O3
Molecular Weight393.49 g/mol
Exact Mass393.21
IUPAC Name2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(CC(=O)Nc2ccccc2C(=O)N2CCC(C)CC2)cc1
InChIInChI=1S/C23H27N3O3/c1-16-11-13-26(14-12-16)23(29)20-5-3-4-6-21(20)25-22(28)15-18-7-9-19(10-8-18)24-17(2)27/h3-10,16H,11-15H2,1-2H3,(H,24,27)(H,25,28)
InChIKeyGRPQKXDPJBWKPX-UHFFFAOYSA-N
XLogP3.70
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.49
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-acetamidophenyl)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
CID 78806404
2-[[2-(4-acetamidophenyl)acetyl]amino]benzoic acid
CID 108804791
3-(2-chlorophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]propanamide
CID 17179018
[2-(4-methylpiperidine-1-carbonyl)phenyl]thiourea
CID 169356775
2-(4-aminophenyl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 54795746
2-(4-methylphenoxy)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 4939349
2-(4-aminophenyl)-N-[2-(4-methylpiperazine-1-carbonyl)phenyl]acetamide
CID 54795789
N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide
CID 4939416
2-[2-(4-methylpiperidine-1-carbonyl)anilino]ethene-1,1,2-tricarbonitrile
CID 168607156
4-methyl-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]benzamide
CID 566959
N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-2,2-diphenylacetamide
CID 4939344
N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide
CID 51942969

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide (CID 87030997) is 2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide is CC(=O)Nc1ccc(CC(=O)Nc2ccccc2C(=O)N2CCC(C)CC2)cc1.
What is the InChIKey of 2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide?
The InChIKey is GRPQKXDPJBWKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O3/c1-16-11-13-26(14-12-16)23(29)20-5-3-4-6-21(20)25-22(28)15-18-7-9-19(10-8-18)24-17(2)27/h3-10,16H,11-15H2,1-2H3,(H,24,27)(H,25,28).
What are the key properties of 2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide?
2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide has a molecular weight of 393.49 g/mol, XLogP of 3.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidophenyl)-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]acetamide is sourced from PubChem (CID 87030997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).