2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide

C25H34N2O2 — CID 55753957

IUPAC2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide
SMILESCCC(C)c1ccccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1
InChIInChI=1S/C25H34N2O2/c1-4-19(2)23-11-7-8-12-24(23)29-18-25(28)26-22-13-15-27(16-14-22)17-21-10-6-5-9-20(21)3/h5-12,19,22H,4,13-18H2,1-3H3,(H,26,28)
InChIKeyFUSBLTUYDIIXGG-UHFFFAOYSA-N
MW394.56 g/mol
LogP4.67
Rot. Bonds8

About 2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide

2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide (PubChem CID 55753957) has the molecular formula C25H34N2O2 and a molecular weight of 394.56 g/mol. Its IUPAC name is 2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide
PubChem CID55753957
Molecular FormulaC25H34N2O2
Molecular Weight394.56 g/mol
Exact Mass394.26
IUPAC Name2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide
SMILESCCC(C)c1ccccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1
InChIInChI=1S/C25H34N2O2/c1-4-19(2)23-11-7-8-12-24(23)29-18-25(28)26-22-13-15-27(16-14-22)17-21-10-6-5-9-20(21)3/h5-12,19,22H,4,13-18H2,1-3H3,(H,26,28)
InChIKeyFUSBLTUYDIIXGG-UHFFFAOYSA-N
XLogP4.67
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.56
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide with MolForge

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Related Compounds

2-[(Z)-(1-amino-2-methylpropylidene)amino]oxy-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide
CID 167988186
N-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 55951851
4-(2-bromophenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]butanamide
CID 55866230
2-acetamido-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]propanamide
CID 87020158
N-cyclohexyl-2-(2-propan-2-ylphenoxy)acetamide
CID 725880
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-2-(2-methylphenoxy)acetamide
CID 110819454
1-(2-ethyl-2-hydroxybutyl)-3-[1-[(2-methylphenyl)methyl]piperidin-4-yl]urea
CID 110910101
2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide
CID 78901882
N-[4-[[1-[(2-methylphenyl)methyl]piperidin-4-yl]amino]-4-oxobutan-2-yl]benzamide
CID 55753716
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-(2-methylphenoxy)acetamide
CID 110819905
2-(2-ethoxyphenoxy)-N-(1-methylpiperidin-4-yl)acetamide
CID 86907088
N-cycloheptyl-2-[2-[(1S)-1-hydroxyethyl]phenoxy]acetamide
CID 78933846

Frequently Asked Questions

What is the IUPAC name of 2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide?
The IUPAC name of 2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide (CID 55753957) is 2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide.
What is the SMILES notation for 2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide?
The canonical SMILES for 2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide is CCC(C)c1ccccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1.
What is the InChIKey of 2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide?
The InChIKey is FUSBLTUYDIIXGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H34N2O2/c1-4-19(2)23-11-7-8-12-24(23)29-18-25(28)26-22-13-15-27(16-14-22)17-21-10-6-5-9-20(21)3/h5-12,19,22H,4,13-18H2,1-3H3,(H,26,28).
What are the key properties of 2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide?
2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide has a molecular weight of 394.56 g/mol, XLogP of 4.67, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-butan-2-ylphenoxy)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 55753957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).