N-(2,4-dicyclopentylquinolin-8-yl)acetamide

C21H26N2O — CID 154719830

IUPACN-(2,4-dicyclopentylquinolin-8-yl)acetamide
SMILESCC(=O)Nc1cccc2c(C3CCCC3)cc(C3CCCC3)nc12
InChIInChI=1S/C21H26N2O/c1-14(24)22-19-12-6-11-17-18(15-7-2-3-8-15)13-20(23-21(17)19)16-9-4-5-10-16/h6,11-13,15-16H,2-5,7-10H2,1H3,(H,22,24)
InChIKeyRSIRNRSAVNNQFW-UHFFFAOYSA-N
MW322.45 g/mol
LogP5.51
Rot. Bonds3

About N-(2,4-dicyclopentylquinolin-8-yl)acetamide

N-(2,4-dicyclopentylquinolin-8-yl)acetamide (PubChem CID 154719830) has the molecular formula C21H26N2O and a molecular weight of 322.45 g/mol. Its IUPAC name is N-(2,4-dicyclopentylquinolin-8-yl)acetamide.

Molecular Properties

Compound NameN-(2,4-dicyclopentylquinolin-8-yl)acetamide
PubChem CID154719830
Molecular FormulaC21H26N2O
Molecular Weight322.45 g/mol
Exact Mass322.20
IUPAC NameN-(2,4-dicyclopentylquinolin-8-yl)acetamide
SMILESCC(=O)Nc1cccc2c(C3CCCC3)cc(C3CCCC3)nc12
InChIInChI=1S/C21H26N2O/c1-14(24)22-19-12-6-11-17-18(15-7-2-3-8-15)13-20(23-21(17)19)16-9-4-5-10-16/h6,11-13,15-16H,2-5,7-10H2,1H3,(H,22,24)
InChIKeyRSIRNRSAVNNQFW-UHFFFAOYSA-N
XLogP5.51
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.45
LogP ≤ 55.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dicyclopentylquinolin-8-yl)acetamide?
The IUPAC name of N-(2,4-dicyclopentylquinolin-8-yl)acetamide (CID 154719830) is N-(2,4-dicyclopentylquinolin-8-yl)acetamide.
What is the SMILES notation for N-(2,4-dicyclopentylquinolin-8-yl)acetamide?
The canonical SMILES for N-(2,4-dicyclopentylquinolin-8-yl)acetamide is CC(=O)Nc1cccc2c(C3CCCC3)cc(C3CCCC3)nc12.
What is the InChIKey of N-(2,4-dicyclopentylquinolin-8-yl)acetamide?
The InChIKey is RSIRNRSAVNNQFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O/c1-14(24)22-19-12-6-11-17-18(15-7-2-3-8-15)13-20(23-21(17)19)16-9-4-5-10-16/h6,11-13,15-16H,2-5,7-10H2,1H3,(H,22,24).
What are the key properties of N-(2,4-dicyclopentylquinolin-8-yl)acetamide?
N-(2,4-dicyclopentylquinolin-8-yl)acetamide has a molecular weight of 322.45 g/mol, XLogP of 5.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dicyclopentylquinolin-8-yl)acetamide is sourced from PubChem (CID 154719830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).