2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide

C22H28N2O2 — CID 2464605

IUPAC2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)CN1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C22H28N2O2/c1-17-8-9-21(26-2)20(14-17)23-22(25)16-24-12-10-19(11-13-24)15-18-6-4-3-5-7-18/h3-9,14,19H,10-13,15-16H2,1-2H3,(H,23,25)
InChIKeySFXQEEZPOGABTH-UHFFFAOYSA-N
MW352.48 g/mol
LogP3.90
Rot. Bonds6

About 2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide

2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide (PubChem CID 2464605) has the molecular formula C22H28N2O2 and a molecular weight of 352.48 g/mol. Its IUPAC name is 2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide
PubChem CID2464605
Molecular FormulaC22H28N2O2
Molecular Weight352.48 g/mol
Exact Mass352.22
IUPAC Name2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)CN1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C22H28N2O2/c1-17-8-9-21(26-2)20(14-17)23-22(25)16-24-12-10-19(11-13-24)15-18-6-4-3-5-7-18/h3-9,14,19H,10-13,15-16H2,1-2H3,(H,23,25)
InChIKeySFXQEEZPOGABTH-UHFFFAOYSA-N
XLogP3.90
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-benzylpiperidin-1-yl)-N-(2,4-dimethoxyphenyl)acetamide
CID 2573036
2-(4-benzylpiperidin-1-yl)-N-(3-chloro-4-methoxyphenyl)acetamide
CID 16554623
2-(azocan-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide
CID 4800986
3-(4-benzylpiperidin-1-yl)-N-(2,5-dimethoxyphenyl)-3-oxopropanamide
CID 108952160
2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-N-(2-methoxy-5-methylphenyl)acetamide
CID 33073903
N-(2-methoxy-5-methylphenyl)-2-[4-(2-methyl-1H-indol-3-yl)piperidin-1-yl]acetamide
CID 60506456
1-(2-methoxy-5-methylphenyl)-3-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methyl]urea
CID 23609182
3-(4-benzylpiperidin-1-yl)-N-(2,4-dimethylphenyl)propanamide
CID 109032554
2-[[2-[4-(2,6-dimethoxyphenoxy)piperidin-1-yl]acetyl]amino]-N-(2-methoxy-5-methylphenyl)acetamide
CID 55838143
2-(4-benzylpiperidin-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 8904460
3-(4-benzylpiperidin-1-yl)-N-(2-methoxyphenyl)-3-oxopropanamide
CID 108952152
N-(2-methoxyphenyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119922615

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide?
The IUPAC name of 2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide (CID 2464605) is 2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide.
What is the SMILES notation for 2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide?
The canonical SMILES for 2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide is COc1ccc(C)cc1NC(=O)CN1CCC(Cc2ccccc2)CC1.
What is the InChIKey of 2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide?
The InChIKey is SFXQEEZPOGABTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O2/c1-17-8-9-21(26-2)20(14-17)23-22(25)16-24-12-10-19(11-13-24)15-18-6-4-3-5-7-18/h3-9,14,19H,10-13,15-16H2,1-2H3,(H,23,25).
What are the key properties of 2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide?
2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide has a molecular weight of 352.48 g/mol, XLogP of 3.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzylpiperidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide is sourced from PubChem (CID 2464605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).