N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide

C28H30N2O3 — CID 108549605

IUPACN-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide
SMILESO=C(NC1CCN(C(=O)CCOc2ccccc2)CC1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H30N2O3/c31-26(18-21-33-25-14-8-3-9-15-25)30-19-16-24(17-20-30)29-28(32)27(22-10-4-1-5-11-22)23-12-6-2-7-13-23/h1-15,24,27H,16-21H2,(H,29,32)
InChIKeyXKVQWFYBJUPXIZ-UHFFFAOYSA-N
MW442.56 g/mol
LogP4.39
Rot. Bonds8

About N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide

N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide (PubChem CID 108549605) has the molecular formula C28H30N2O3 and a molecular weight of 442.56 g/mol. Its IUPAC name is N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide
PubChem CID108549605
Molecular FormulaC28H30N2O3
Molecular Weight442.56 g/mol
Exact Mass442.23
IUPAC NameN-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide
SMILESO=C(NC1CCN(C(=O)CCOc2ccccc2)CC1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H30N2O3/c31-26(18-21-33-25-14-8-3-9-15-25)30-19-16-24(17-20-30)29-28(32)27(22-10-4-1-5-11-22)23-12-6-2-7-13-23/h1-15,24,27H,16-21H2,(H,29,32)
InChIKeyXKVQWFYBJUPXIZ-UHFFFAOYSA-N
XLogP4.39
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.56
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-phenoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]acetamide
CID 108555833
1-[1-(3-phenoxypropanoyl)piperidin-4-yl]-3-propan-2-ylurea
CID 110820909
N-[1-(3-phenoxypropanoyl)piperidin-4-yl]butanamide
CID 110820896
2-chloroethyl N-[1-(3-phenoxypropanoyl)piperidin-4-yl]carbamate
CID 108565920
2-cyano-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]acetamide
CID 108548392
2-(1,3-dioxoisoindol-2-yl)-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]acetamide
CID 108551978
ethyl 4-[4-[(2,2-diphenylacetyl)amino]piperidin-1-yl]-4-oxobutanoate
CID 108559440
2-methyl-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide
CID 39512486
2-fluoro-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide
CID 108549375
4-methyl-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide
CID 108549132
1-[4-(cyclopropylmethylamino)piperidin-1-yl]-3-phenoxypropan-1-one;hydrochloride
CID 119623158
4-(4-methylphenoxy)-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]butanamide
CID 108553445

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide?
The IUPAC name of N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide (CID 108549605) is N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide?
The canonical SMILES for N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide is O=C(NC1CCN(C(=O)CCOc2ccccc2)CC1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide?
The InChIKey is XKVQWFYBJUPXIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H30N2O3/c31-26(18-21-33-25-14-8-3-9-15-25)30-19-16-24(17-20-30)29-28(32)27(22-10-4-1-5-11-22)23-12-6-2-7-13-23/h1-15,24,27H,16-21H2,(H,29,32).
What are the key properties of N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide?
N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide has a molecular weight of 442.56 g/mol, XLogP of 4.39, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide is sourced from PubChem (CID 108549605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).