2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide

C20H24N2O2 — CID 889075

IUPAC2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide
SMILESCc1cccc(OCC(=O)Nc2ccccc2N2CCCCC2)c1
InChIInChI=1S/C20H24N2O2/c1-16-8-7-9-17(14-16)24-15-20(23)21-18-10-3-4-11-19(18)22-12-5-2-6-13-22/h3-4,7-11,14H,2,5-6,12-13,15H2,1H3,(H,21,23)
InChIKeyDKFDCHYVRSKAQJ-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.00
Rot. Bonds5

About 2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide

2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide (PubChem CID 889075) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide
PubChem CID889075
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide
SMILESCc1cccc(OCC(=O)Nc2ccccc2N2CCCCC2)c1
InChIInChI=1S/C20H24N2O2/c1-16-8-7-9-17(14-16)24-15-20(23)21-18-10-3-4-11-19(18)22-12-5-2-6-13-22/h3-4,7-11,14H,2,5-6,12-13,15H2,1H3,(H,21,23)
InChIKeyDKFDCHYVRSKAQJ-UHFFFAOYSA-N
XLogP4.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-(Benzyloxy)phenyl)piperazine
CID 22615724
Acetamide, N-(4-(3-(4-(2-methoxyphenyl)-1-piperazinyl)propoxy)phenyl)-
CID 55421
4-(2-Piperidin-1-ylethyl)-7-propyl-1,4-benzoxazin-3-one
CID 59630032
2-(4-methylpiperazino)-N-(2-phenoxyphenyl)acetamide
CID 2813152
N-(4-methylphenyl)-2-[methyl-[2-(2-phenylphenoxy)acetyl]amino]acetamide
CID 4790602
2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-methylphenyl)acetamide
CID 2653640
4-Benzyl-8-(piperazin-1-yl)-4H-benzo[1,4]oxazin-3-one
CID 10019089
7-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-4-methyl-4H-benzo[1,4]oxazin-3-one
CID 10573576
7-{2-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-ethyl}-4-methyl-4H-benzo[1,4]oxazin-3-one
CID 10809876
2-(4-methoxyphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 3160214
Acetamide, N-(4-(3-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)propoxy)phenyl)-
CID 55424
1-(3,4-dihydroquinolin-1(2H)-yl)-2-(o-tolyloxy)ethanone
CID 724133

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide?
The IUPAC name of 2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide (CID 889075) is 2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide is Cc1cccc(OCC(=O)Nc2ccccc2N2CCCCC2)c1.
What is the InChIKey of 2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide?
The InChIKey is DKFDCHYVRSKAQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-16-8-7-9-17(14-16)24-15-20(23)21-18-10-3-4-11-19(18)22-12-5-2-6-13-22/h3-4,7-11,14H,2,5-6,12-13,15H2,1H3,(H,21,23).
What are the key properties of 2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide?
2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide has a molecular weight of 324.42 g/mol, XLogP of 4.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenoxy)-N-(2-piperidin-1-ylphenyl)acetamide is sourced from PubChem (CID 889075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).