2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide

C21H26N2O3 — CID 78804056

IUPAC2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)Nc2ccc(N3CCCCC3)cc2)c1
InChIInChI=1S/C21H26N2O3/c1-25-19-10-11-20(26-2)16(14-19)15-21(24)22-17-6-8-18(9-7-17)23-12-4-3-5-13-23/h6-11,14H,3-5,12-13,15H2,1-2H3,(H,22,24)
InChIKeyQZNZYAMZUVUQQW-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.88
Rot. Bonds6

About 2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide

2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide (PubChem CID 78804056) has the molecular formula C21H26N2O3 and a molecular weight of 354.45 g/mol. Its IUPAC name is 2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide
PubChem CID78804056
Molecular FormulaC21H26N2O3
Molecular Weight354.45 g/mol
Exact Mass354.19
IUPAC Name2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)Nc2ccc(N3CCCCC3)cc2)c1
InChIInChI=1S/C21H26N2O3/c1-25-19-10-11-20(26-2)16(14-19)15-21(24)22-17-6-8-18(9-7-17)23-12-4-3-5-13-23/h6-11,14H,3-5,12-13,15H2,1-2H3,(H,22,24)
InChIKeyQZNZYAMZUVUQQW-UHFFFAOYSA-N
XLogP3.88
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-(2,5-dimethoxyphenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 78807074
[2-[4-(azepan-1-yl)anilino]-2-oxoethyl] 2,4-dimethoxybenzoate
CID 9203566
N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide
CID 78804409
N'-(2,5-dimethoxyphenyl)-N-(4-pyrrolidin-1-ylphenyl)oxamide
CID 108987415
2-(2,5-dimethoxyphenyl)-N-(4-imidazol-1-ylphenyl)acetamide
CID 78845002
2-(2,5-dimethoxyphenyl)-N-(3,4-dimethylphenyl)acetamide
CID 78804402
2-(4-methoxyphenyl)sulfanyl-N-(4-piperidin-1-ylphenyl)acetamide
CID 7579194
N-[4-(azepan-1-yl)phenyl]-2-[(4-methoxyphenyl)carbamoylamino]acetamide
CID 17463645
2-(3,4-dimethoxyanilino)-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 109009591
[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl] (E)-3-(2,5-dimethoxyphenyl)prop-2-enoate
CID 26750295
3-(3,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)propanamide
CID 26689927
2-(2,5-dimethoxyphenyl)-N-[3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-1H-indol-5-yl]acetamide
CID 46102324

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide?
The IUPAC name of 2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide (CID 78804056) is 2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide is COc1ccc(OC)c(CC(=O)Nc2ccc(N3CCCCC3)cc2)c1.
What is the InChIKey of 2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide?
The InChIKey is QZNZYAMZUVUQQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O3/c1-25-19-10-11-20(26-2)16(14-19)15-21(24)22-17-6-8-18(9-7-17)23-12-4-3-5-13-23/h6-11,14H,3-5,12-13,15H2,1-2H3,(H,22,24).
What are the key properties of 2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide?
2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide has a molecular weight of 354.45 g/mol, XLogP of 3.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide is sourced from PubChem (CID 78804056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).