4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide

C22H20N2O2 — CID 30870123

IUPAC4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide
SMILESNC(=O)c1ccc(C(=O)NCC(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C22H20N2O2/c23-21(25)18-11-13-19(14-12-18)22(26)24-15-20(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14,20H,15H2,(H2,23,25)(H,24,26)
InChIKeyXFOXFSBJCDIIBQ-UHFFFAOYSA-N
MW344.41 g/mol
LogP3.35
Rot. Bonds6

About 4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide

4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide (PubChem CID 30870123) has the molecular formula C22H20N2O2 and a molecular weight of 344.41 g/mol. Its IUPAC name is 4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide
PubChem CID30870123
Molecular FormulaC22H20N2O2
Molecular Weight344.41 g/mol
Exact Mass344.15
IUPAC Name4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide
SMILESNC(=O)c1ccc(C(=O)NCC(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C22H20N2O2/c23-21(25)18-11-13-19(14-12-18)22(26)24-15-20(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14,20H,15H2,(H2,23,25)(H,24,26)
InChIKeyXFOXFSBJCDIIBQ-UHFFFAOYSA-N
XLogP3.35
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-N-(2,2-diaminoethyl)benzene-1,4-dicarboxamide
CID 172799117
N-(2,2-diphenylethyl)-4-methylsulfinylbenzamide
CID 51185162
3-(carbamoylamino)-N-(2,2-diphenylethyl)benzamide
CID 26313248
4-N-[(2S)-2-hydroxypropyl]benzene-1,4-dicarboxamide
CID 83059637
4-N-(2-hydroxy-1-phenylethyl)benzene-1,4-dicarboxamide
CID 63182176
N-[2-(2,2-diphenylethylamino)-2-oxoethyl]-4-fluorobenzamide
CID 26795770
1-N,4-N-bis(3,3-diphenylpropyl)benzene-1,4-dicarboxamide
CID 5181795
N-[(2S)-2-hydroxy-2-phenylethyl]benzamide
CID 6542363
4-N-(2-anilinoethyl)benzene-1,4-dicarboxamide
CID 154348827
4-[[[(2,2-diphenylethylamino)-(ethylamino)methylidene]amino]methyl]benzamide
CID 111356892
4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide
CID 55415145
N-[4-(2,2-diphenylethylcarbamoyl)phenyl]furan-2-carboxamide
CID 9450262

Frequently Asked Questions

What is the IUPAC name of 4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide?
The IUPAC name of 4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide (CID 30870123) is 4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide.
What is the SMILES notation for 4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide?
The canonical SMILES for 4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide is NC(=O)c1ccc(C(=O)NCC(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide?
The InChIKey is XFOXFSBJCDIIBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O2/c23-21(25)18-11-13-19(14-12-18)22(26)24-15-20(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14,20H,15H2,(H2,23,25)(H,24,26).
What are the key properties of 4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide?
4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide has a molecular weight of 344.41 g/mol, XLogP of 3.35, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2,2-diphenylethyl)benzene-1,4-dicarboxamide is sourced from PubChem (CID 30870123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).