2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide

C20H24N2O2 — CID 110735883

IUPAC2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide
SMILESCc1ccccc1OCC(=O)NC1CCN(c2ccccc2)CC1
InChIInChI=1S/C20H24N2O2/c1-16-7-5-6-10-19(16)24-15-20(23)21-17-11-13-22(14-12-17)18-8-3-2-4-9-18/h2-10,17H,11-15H2,1H3,(H,21,23)
InChIKeyXCRVBCFTIFQACI-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.16
Rot. Bonds5

About 2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide

2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide (PubChem CID 110735883) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide.

Molecular Properties

Compound Name2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide
PubChem CID110735883
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide
SMILESCc1ccccc1OCC(=O)NC1CCN(c2ccccc2)CC1
InChIInChI=1S/C20H24N2O2/c1-16-7-5-6-10-19(16)24-15-20(23)21-17-11-13-22(14-12-17)18-8-3-2-4-9-18/h2-10,17H,11-15H2,1H3,(H,21,23)
InChIKeyXCRVBCFTIFQACI-UHFFFAOYSA-N
XLogP3.16
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 ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-(2-methylphenoxy)acetamide
CID 110819905
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-2-(2-methylphenoxy)acetamide
CID 110819454
2-(2-methylphenoxy)-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]acetamide
CID 90597199
N-cyclopropyl-2-(2-hydroxyphenoxy)acetamide
CID 2687934
2-(2-ethoxyphenoxy)-N-(1-methylpiperidin-4-yl)acetamide
CID 86907088
N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(2-methylphenoxy)acetamide
CID 3892335
N-(1-acetylpiperidin-4-yl)-4-(2-methylphenoxy)butanamide
CID 108561273
2-(2,3-dimethylphenoxy)-N-[1-(2-hydroxybenzoyl)piperidin-4-yl]acetamide
CID 108552814
2-(2,3-dimethylphenoxy)-N-(4-hydroxycyclohexyl)acetamide
CID 43389110
N-(1-phenylpiperidin-4-yl)acetamide;hydrochloride
CID 155657873
N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]-2-(2,3-dimethylphenoxy)acetamide
CID 108552797
N-(1-butanoylpiperidin-4-yl)-2-(2,3-dimethylphenoxy)acetamide
CID 108560809

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide?
The IUPAC name of 2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide (CID 110735883) is 2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide.
What is the SMILES notation for 2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide?
The canonical SMILES for 2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide is Cc1ccccc1OCC(=O)NC1CCN(c2ccccc2)CC1.
What is the InChIKey of 2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide?
The InChIKey is XCRVBCFTIFQACI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-16-7-5-6-10-19(16)24-15-20(23)21-17-11-13-22(14-12-17)18-8-3-2-4-9-18/h2-10,17H,11-15H2,1H3,(H,21,23).
What are the key properties of 2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide?
2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide has a molecular weight of 324.42 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenoxy)-N-(1-phenylpiperidin-4-yl)acetamide is sourced from PubChem (CID 110735883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).