2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide

C23H30N2O3 — CID 78901882

IUPAC2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide
SMILESCOc1ccc(OC)c(CC(=O)NC2CCN(Cc3ccccc3C)CC2)c1
InChIInChI=1S/C23H30N2O3/c1-17-6-4-5-7-18(17)16-25-12-10-20(11-13-25)24-23(26)15-19-14-21(27-2)8-9-22(19)28-3/h4-9,14,20H,10-13,15-16H2,1-3H3,(H,24,26)
InChIKeyZPCRNXCKHUZMCP-UHFFFAOYSA-N
MW382.50 g/mol
LogP3.34
Rot. Bonds7

About 2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide

2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide (PubChem CID 78901882) has the molecular formula C23H30N2O3 and a molecular weight of 382.50 g/mol. Its IUPAC name is 2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide
PubChem CID78901882
Molecular FormulaC23H30N2O3
Molecular Weight382.50 g/mol
Exact Mass382.23
IUPAC Name2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide
SMILESCOc1ccc(OC)c(CC(=O)NC2CCN(Cc3ccccc3C)CC2)c1
InChIInChI=1S/C23H30N2O3/c1-17-6-4-5-7-18(17)16-25-12-10-20(11-13-25)24-23(26)15-19-14-21(27-2)8-9-22(19)28-3/h4-9,14,20H,10-13,15-16H2,1-3H3,(H,24,26)
InChIKeyZPCRNXCKHUZMCP-UHFFFAOYSA-N
XLogP3.34
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.50
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]acetamide
CID 78806562
2,5-dimethoxy-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]benzenesulfonamide
CID 60540087
N-cycloheptyl-2-(2,5-dimethoxyphenyl)acetamide
CID 7580886
2-(2,5-dimethoxyphenyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide
CID 78876192
N-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 55951851
2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-N-[2-(2-methylphenyl)ethyl]acetamide
CID 38386256
N-(4-aminocyclohexyl)-2-(2,5-dimethoxyphenyl)acetamide
CID 119476462
N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]acetamide
CID 8596439
N-cyclopropyl-2-[(2,5-dimethoxyphenyl)methylamino]acetamide
CID 43401917
N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-(2-methoxyphenyl)acetamide
CID 18121021
N-cyclopentyl-4-[(2,5-dimethoxyphenyl)methyl]piperazine-1-carboxamide
CID 17174343
1-[1-(3-methoxyphenyl)propan-2-yl]-3-[1-[(2-methylphenyl)methyl]piperidin-4-yl]urea
CID 86943158

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide?
The IUPAC name of 2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide (CID 78901882) is 2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide.
What is the SMILES notation for 2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide?
The canonical SMILES for 2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide is COc1ccc(OC)c(CC(=O)NC2CCN(Cc3ccccc3C)CC2)c1.
What is the InChIKey of 2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide?
The InChIKey is ZPCRNXCKHUZMCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O3/c1-17-6-4-5-7-18(17)16-25-12-10-20(11-13-25)24-23(26)15-19-14-21(27-2)8-9-22(19)28-3/h4-9,14,20H,10-13,15-16H2,1-3H3,(H,24,26).
What are the key properties of 2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide?
2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide has a molecular weight of 382.50 g/mol, XLogP of 3.34, 7 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-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 78901882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).