1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide

C23H23ClN2O2 — CID 100770049

IUPAC1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide
SMILESCCOc1ccc(NC(=O)C2(c3ccc(Cl)cc3)CCCC2)c2cccnc12
InChIInChI=1S/C23H23ClN2O2/c1-2-28-20-12-11-19(18-6-5-15-25-21(18)20)26-22(27)23(13-3-4-14-23)16-7-9-17(24)10-8-16/h5-12,15H,2-4,13-14H2,1H3,(H,26,27)
InChIKeyGDONCNJGGNMKOW-UHFFFAOYSA-N
MW394.90 g/mol
LogP5.74
Rot. Bonds5

About 1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide

1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide (PubChem CID 100770049) has the molecular formula C23H23ClN2O2 and a molecular weight of 394.90 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide
PubChem CID100770049
Molecular FormulaC23H23ClN2O2
Molecular Weight394.90 g/mol
Exact Mass394.14
IUPAC Name1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide
SMILESCCOc1ccc(NC(=O)C2(c3ccc(Cl)cc3)CCCC2)c2cccnc12
InChIInChI=1S/C23H23ClN2O2/c1-2-28-20-12-11-19(18-6-5-15-25-21(18)20)26-22(27)23(13-3-4-14-23)16-7-9-17(24)10-8-16/h5-12,15H,2-4,13-14H2,1H3,(H,26,27)
InChIKeyGDONCNJGGNMKOW-UHFFFAOYSA-N
XLogP5.74
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.90
LogP ≤ 55.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-chlorophenyl)-N-(8-propoxyquinolin-5-yl)oxane-4-carboxamide
CID 100772965
1-(4-methylphenyl)-N-[8-(2-methylpropoxy)quinolin-5-yl]cyclohexane-1-carboxamide
CID 100770996
1-(2,4-dichlorophenyl)-N-(8-propoxyquinolin-5-yl)cyclohexane-1-carboxamide
CID 100771786
N-(8-methoxyquinolin-5-yl)-1-phenylcyclohexane-1-carboxamide
CID 100770558
1-(4-methoxyphenyl)-N-(8-propan-2-yloxyquinolin-5-yl)cyclopentane-1-carboxamide
CID 100770449
1-(4-chlorophenyl)-N-(2,5-diethoxyphenyl)cyclopropane-1-carboxamide
CID 112765724
4-(4-fluorophenyl)-N-(8-methoxyquinolin-5-yl)oxane-4-carboxamide
CID 100772769
1-(4-chlorophenyl)-N-[4-(2-methylpropoxy)naphthalen-1-yl]cyclopropane-1-carboxamide
CID 100782430
1-methoxy-N-[8-(2-methylpropoxy)quinolin-5-yl]cyclopentane-1-carboxamide
CID 100775150
1-(4-chlorophenyl)-N-(2-cyano-4-ethoxyphenyl)cyclohexane-1-carboxamide
CID 100746676
2-(4-chlorophenoxy)-N-(8-methoxyquinolin-5-yl)acetamide
CID 26823034
N-(4-ethoxynaphthalen-1-yl)-4-(4-methoxyphenyl)oxane-4-carboxamide
CID 100750314

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide (CID 100770049) is 1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide is CCOc1ccc(NC(=O)C2(c3ccc(Cl)cc3)CCCC2)c2cccnc12.
What is the InChIKey of 1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide?
The InChIKey is GDONCNJGGNMKOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23ClN2O2/c1-2-28-20-12-11-19(18-6-5-15-25-21(18)20)26-22(27)23(13-3-4-14-23)16-7-9-17(24)10-8-16/h5-12,15H,2-4,13-14H2,1H3,(H,26,27).
What are the key properties of 1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide?
1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide has a molecular weight of 394.90 g/mol, XLogP of 5.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-(8-ethoxyquinolin-5-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 100770049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).