N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide

C29H34N2O2 — CID 25205437

IUPACN-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(CC(=O)NC2CCN(CCC(c3ccccc3)c3ccccc3)CC2)c1
InChIInChI=1S/C29H34N2O2/c1-33-27-14-8-9-23(21-27)22-29(32)30-26-15-18-31(19-16-26)20-17-28(24-10-4-2-5-11-24)25-12-6-3-7-13-25/h2-14,21,26,28H,15-20,22H2,1H3,(H,30,32)
InChIKeyZEYKYBGWCCFGPW-UHFFFAOYSA-N
MW442.60 g/mol
LogP5.04
Rot. Bonds9

About N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide

N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide (PubChem CID 25205437) has the molecular formula C29H34N2O2 and a molecular weight of 442.60 g/mol. Its IUPAC name is N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide
PubChem CID25205437
Molecular FormulaC29H34N2O2
Molecular Weight442.60 g/mol
Exact Mass442.26
IUPAC NameN-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(CC(=O)NC2CCN(CCC(c3ccccc3)c3ccccc3)CC2)c1
InChIInChI=1S/C29H34N2O2/c1-33-27-14-8-9-23(21-27)22-29(32)30-26-15-18-31(19-16-26)20-17-28(24-10-4-2-5-11-24)25-12-6-3-7-13-25/h2-14,21,26,28H,15-20,22H2,1H3,(H,30,32)
InChIKeyZEYKYBGWCCFGPW-UHFFFAOYSA-N
XLogP5.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500442.60
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(4-hydroxyphenyl)acetamide
CID 25205927
N-cyclohexyl-2-(3-methoxyphenyl)acetamide
CID 16618770
2-(3-methoxyphenyl)-N-[4-(methylamino)cyclohexyl]acetamide
CID 43653164
2-(4-cyanophenyl)-N-[1-(3,3-diphenylpropyl)piperidin-4-yl]acetamide
CID 25206081
N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 25205776
N-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-3-phenoxypropanamide
CID 51123832
N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(4-sulfamoylphenyl)acetamide
CID 25205608
N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide
CID 108551244
N-[1-(3,3-dimethylbutanoyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide
CID 110822281
N-cyclohexyl-2-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]acetamide
CID 22195059
N-[1-[2-[4-(6-amino-2-pyridinyl)phenyl]ethyl]pyrrolidin-3-yl]-2-(3-methoxyphenyl)acetamide
CID 70006888
N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide
CID 56783035

Frequently Asked Questions

What is the IUPAC name of N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide?
The IUPAC name of N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide (CID 25205437) is N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide.
What is the SMILES notation for N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide?
The canonical SMILES for N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide is COc1cccc(CC(=O)NC2CCN(CCC(c3ccccc3)c3ccccc3)CC2)c1.
What is the InChIKey of N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide?
The InChIKey is ZEYKYBGWCCFGPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H34N2O2/c1-33-27-14-8-9-23(21-27)22-29(32)30-26-15-18-31(19-16-26)20-17-28(24-10-4-2-5-11-24)25-12-6-3-7-13-25/h2-14,21,26,28H,15-20,22H2,1H3,(H,30,32).
What are the key properties of N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide?
N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide has a molecular weight of 442.60 g/mol, XLogP of 5.04, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 25205437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).