N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide

C24H25NO2 — CID 55371775

IUPACN-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide
SMILESCCC(NC(=O)C(c1ccccc1)c1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C24H25NO2/c1-3-22(18-14-16-21(27-2)17-15-18)25-24(26)23(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-17,22-23H,3H2,1-2H3,(H,25,26)
InChIKeyBWXRVLKRKVSEFL-UHFFFAOYSA-N
MW359.47 g/mol
LogP5.09
Rot. Bonds7

About N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide

N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide (PubChem CID 55371775) has the molecular formula C24H25NO2 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide
PubChem CID55371775
Molecular FormulaC24H25NO2
Molecular Weight359.47 g/mol
Exact Mass359.19
IUPAC NameN-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide
SMILESCCC(NC(=O)C(c1ccccc1)c1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C24H25NO2/c1-3-22(18-14-16-21(27-2)17-15-18)25-24(26)23(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-17,22-23H,3H2,1-2H3,(H,25,26)
InChIKeyBWXRVLKRKVSEFL-UHFFFAOYSA-N
XLogP5.09
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.47
LogP ≤ 55.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide?
The IUPAC name of N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide (CID 55371775) is N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide is CCC(NC(=O)C(c1ccccc1)c1ccccc1)c1ccc(OC)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide?
The InChIKey is BWXRVLKRKVSEFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO2/c1-3-22(18-14-16-21(27-2)17-15-18)25-24(26)23(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-17,22-23H,3H2,1-2H3,(H,25,26).
What are the key properties of N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide?
N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide has a molecular weight of 359.47 g/mol, XLogP of 5.09, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide is sourced from PubChem (CID 55371775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).