N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide

C20H23NO — CID 626194

IUPACN-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide
SMILESCC(=O)Nc1cc2ccc1CCCc1ccc(cc1)CCC2
InChIInChI=1S/C20H23NO/c1-15(22)21-20-14-18-6-2-4-16-8-10-17(11-9-16)5-3-7-19(20)13-12-18/h8-14H,2-7H2,1H3,(H,21,22)
InChIKeyGWQROEQTLXQFKH-UHFFFAOYSA-N
MW293.41 g/mol
LogP4.31
Rot. Bonds1

About N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide

N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide (PubChem CID 626194) has the molecular formula C20H23NO and a molecular weight of 293.41 g/mol. Its IUPAC name is N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide.

Molecular Properties

Compound NameN-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide
PubChem CID626194
Molecular FormulaC20H23NO
Molecular Weight293.41 g/mol
Exact Mass293.18
IUPAC NameN-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide
SMILESCC(=O)Nc1cc2ccc1CCCc1ccc(cc1)CCC2
InChIInChI=1S/C20H23NO/c1-15(22)21-20-14-18-6-2-4-16-8-10-17(11-9-16)5-3-7-19(20)13-12-18/h8-14H,2-7H2,1H3,(H,21,22)
InChIKeyGWQROEQTLXQFKH-UHFFFAOYSA-N
XLogP4.31
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide?
The IUPAC name of N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide (CID 626194) is N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide.
What is the SMILES notation for N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide?
The canonical SMILES for N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide is CC(=O)Nc1cc2ccc1CCCc1ccc(cc1)CCC2.
What is the InChIKey of N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide?
The InChIKey is GWQROEQTLXQFKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO/c1-15(22)21-20-14-18-6-2-4-16-8-10-17(11-9-16)5-3-7-19(20)13-12-18/h8-14H,2-7H2,1H3,(H,21,22).
What are the key properties of N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide?
N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide has a molecular weight of 293.41 g/mol, XLogP of 4.31, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-tricyclo[10.2.2.25,8]octadeca-1(15),5,7,12(16),13,17-hexaenyl)acetamide is sourced from PubChem (CID 626194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).