N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide

C14H26N2O — CID 24832141

IUPACN-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide
SMILESCCN(CC)CC(=O)NC1CC2CCC1CC2
InChIInChI=1S/C14H26N2O/c1-3-16(4-2)10-14(17)15-13-9-11-5-7-12(13)8-6-11/h11-13H,3-10H2,1-2H3,(H,15,17)
InChIKeyJCGKUKSZGZYYJL-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.02
Rot. Bonds5

About N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide

N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide (PubChem CID 24832141) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide
PubChem CID24832141
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide
SMILESCCN(CC)CC(=O)NC1CC2CCC1CC2
InChIInChI=1S/C14H26N2O/c1-3-16(4-2)10-14(17)15-13-9-11-5-7-12(13)8-6-11/h11-13H,3-10H2,1-2H3,(H,15,17)
InChIKeyJCGKUKSZGZYYJL-UHFFFAOYSA-N
XLogP2.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide?
The IUPAC name of N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide (CID 24832141) is N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide.
What is the SMILES notation for N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide?
The canonical SMILES for N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide is CCN(CC)CC(=O)NC1CC2CCC1CC2.
What is the InChIKey of N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide?
The InChIKey is JCGKUKSZGZYYJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-3-16(4-2)10-14(17)15-13-9-11-5-7-12(13)8-6-11/h11-13H,3-10H2,1-2H3,(H,15,17).
What are the key properties of N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide?
N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide has a molecular weight of 238.37 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide is sourced from PubChem (CID 24832141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).