N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide

C20H21NO — CID 583518

IUPACN-[1,2-bis(4-ethenylphenyl)ethyl]acetamide
SMILESC=Cc1ccc(CC(NC(C)=O)c2ccc(C=C)cc2)cc1
InChIInChI=1S/C20H21NO/c1-4-16-6-8-18(9-7-16)14-20(21-15(3)22)19-12-10-17(5-2)11-13-19/h4-13,20H,1-2,14H2,3H3,(H,21,22)
InChIKeyIYFCCCPPSSPAOJ-UHFFFAOYSA-N
MW291.39 g/mol
LogP4.39
Rot. Bonds6

About N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide

N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide (PubChem CID 583518) has the molecular formula C20H21NO and a molecular weight of 291.39 g/mol. Its IUPAC name is N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[1,2-bis(4-ethenylphenyl)ethyl]acetamide
PubChem CID583518
Molecular FormulaC20H21NO
Molecular Weight291.39 g/mol
Exact Mass291.16
IUPAC NameN-[1,2-bis(4-ethenylphenyl)ethyl]acetamide
SMILESC=Cc1ccc(CC(NC(C)=O)c2ccc(C=C)cc2)cc1
InChIInChI=1S/C20H21NO/c1-4-16-6-8-18(9-7-16)14-20(21-15(3)22)19-12-10-17(5-2)11-13-19/h4-13,20H,1-2,14H2,3H3,(H,21,22)
InChIKeyIYFCCCPPSSPAOJ-UHFFFAOYSA-N
XLogP4.39
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide?
The IUPAC name of N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide (CID 583518) is N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide.
What is the SMILES notation for N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide?
The canonical SMILES for N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide is C=Cc1ccc(CC(NC(C)=O)c2ccc(C=C)cc2)cc1.
What is the InChIKey of N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide?
The InChIKey is IYFCCCPPSSPAOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO/c1-4-16-6-8-18(9-7-16)14-20(21-15(3)22)19-12-10-17(5-2)11-13-19/h4-13,20H,1-2,14H2,3H3,(H,21,22).
What are the key properties of N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide?
N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide has a molecular weight of 291.39 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1,2-bis(4-ethenylphenyl)ethyl]acetamide is sourced from PubChem (CID 583518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).