N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide

C22H18N2O — CID 26374350

IUPACN-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide
SMILESN#CCc1ccc(NC(=O)Cc2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C22H18N2O/c23-15-14-17-8-12-21(13-9-17)24-22(25)16-18-6-10-20(11-7-18)19-4-2-1-3-5-19/h1-13H,14,16H2,(H,24,25)
InChIKeyLFGBGPHEOHPCAM-UHFFFAOYSA-N
MW326.40 g/mol
LogP4.60
Rot. Bonds5

About N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide

N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide (PubChem CID 26374350) has the molecular formula C22H18N2O and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide.

Molecular Properties

Compound NameN-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide
PubChem CID26374350
Molecular FormulaC22H18N2O
Molecular Weight326.40 g/mol
Exact Mass326.14
IUPAC NameN-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide
SMILESN#CCc1ccc(NC(=O)Cc2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C22H18N2O/c23-15-14-17-8-12-21(13-9-17)24-22(25)16-18-6-10-20(11-7-18)19-4-2-1-3-5-19/h1-13H,14,16H2,(H,24,25)
InChIKeyLFGBGPHEOHPCAM-UHFFFAOYSA-N
XLogP4.60
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(cyanomethyl)phenyl]-2-phenylacetamide
CID 674697
2-(4-acetamidophenyl)-N-[4-(cyanomethyl)phenyl]acetamide
CID 26375554
N-[4-(cyanomethyl)phenyl]-2-(4-sulfanylphenyl)acetamide
CID 107028125
N-(4-hydroxyphenyl)-2-(4-phenylphenyl)acetamide
CID 71422853
2-cyano-N-[4-(cyanomethyl)phenyl]acetamide
CID 10655606
[4-[[2-(4-phenylphenyl)acetyl]amino]phenyl]boronic acid
CID 127028475
diiodovanadium;2-(4-phenylphenyl)acetic acid;2-(4-phenylphenyl)acetonitrile;vanadium
CID 157274616
[2-[4-(cyanomethyl)anilino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]benzoate
CID 28593747
2-(4-cyanophenyl)-N-phenylacetamide
CID 12672919
3-amino-N-[4-(cyanomethyl)phenyl]-3-phenylpropanamide
CID 43709065
N-[4-(cyanomethyl)phenyl]-3-phenylsulfanylpropanamide
CID 1279971
N-[4-(cyanomethyl)phenyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 3995748

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide?
The IUPAC name of N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide (CID 26374350) is N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide.
What is the SMILES notation for N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide?
The canonical SMILES for N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide is N#CCc1ccc(NC(=O)Cc2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide?
The InChIKey is LFGBGPHEOHPCAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O/c23-15-14-17-8-12-21(13-9-17)24-22(25)16-18-6-10-20(11-7-18)19-4-2-1-3-5-19/h1-13H,14,16H2,(H,24,25).
What are the key properties of N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide?
N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide has a molecular weight of 326.40 g/mol, XLogP of 4.60, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyanomethyl)phenyl]-2-(4-phenylphenyl)acetamide is sourced from PubChem (CID 26374350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).