1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide

C24H24N2O2 — CID 984633

IUPAC1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
SMILESO=C(NCCc1ccccc1)c1ccc(C(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C24H24N2O2/c27-23(25-17-15-19-7-3-1-4-8-19)21-11-13-22(14-12-21)24(28)26-18-16-20-9-5-2-6-10-20/h1-14H,15-18H2,(H,25,27)(H,26,28)
InChIKeyVWAFRDYPCCQYFC-UHFFFAOYSA-N
MW372.47 g/mol
LogP3.63
Rot. Bonds8

About 1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide

1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide (PubChem CID 984633) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is 1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
PubChem CID984633
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC Name1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
SMILESO=C(NCCc1ccccc1)c1ccc(C(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C24H24N2O2/c27-23(25-17-15-19-7-3-1-4-8-19)21-11-13-22(14-12-21)24(28)26-18-16-20-9-5-2-6-10-20/h1-14H,15-18H2,(H,25,27)(H,26,28)
InChIKeyVWAFRDYPCCQYFC-UHFFFAOYSA-N
XLogP3.63
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide?
The IUPAC name of 1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide (CID 984633) is 1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide.
What is the SMILES notation for 1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide?
The canonical SMILES for 1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide is O=C(NCCc1ccccc1)c1ccc(C(=O)NCCc2ccccc2)cc1.
What is the InChIKey of 1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide?
The InChIKey is VWAFRDYPCCQYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O2/c27-23(25-17-15-19-7-3-1-4-8-19)21-11-13-22(14-12-21)24(28)26-18-16-20-9-5-2-6-10-20/h1-14H,15-18H2,(H,25,27)(H,26,28).
What are the key properties of 1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide?
1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide has a molecular weight of 372.47 g/mol, XLogP of 3.63, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide is sourced from PubChem (CID 984633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).