N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide

C17H21N3O — CID 104826466

IUPACN-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide
SMILESNc1ccc(NC(=O)CCC2CCCC2)c2cccnc12
InChIInChI=1S/C17H21N3O/c18-14-8-9-15(13-6-3-11-19-17(13)14)20-16(21)10-7-12-4-1-2-5-12/h3,6,8-9,11-12H,1-2,4-5,7,10,18H2,(H,20,21)
InChIKeyUKRRXYABDLLKCB-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.73
Rot. Bonds4

About N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide

N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide (PubChem CID 104826466) has the molecular formula C17H21N3O and a molecular weight of 283.37 g/mol. Its IUPAC name is N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide.

Molecular Properties

Compound NameN-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide
PubChem CID104826466
Molecular FormulaC17H21N3O
Molecular Weight283.37 g/mol
Exact Mass283.17
IUPAC NameN-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide
SMILESNc1ccc(NC(=O)CCC2CCCC2)c2cccnc12
InChIInChI=1S/C17H21N3O/c18-14-8-9-15(13-6-3-11-19-17(13)14)20-16(21)10-7-12-4-1-2-5-12/h3,6,8-9,11-12H,1-2,4-5,7,10,18H2,(H,20,21)
InChIKeyUKRRXYABDLLKCB-UHFFFAOYSA-N
XLogP3.73
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(8-aminoquinolin-5-yl)cyclopropanecarboxamide
CID 104826399
3-cyclohexyl-N-[5-(3-cyclohexylpropanoylamino)naphthalen-1-yl]propanamide
CID 27126992
5-N-(cyclohexylmethyl)quinoline-5,8-diamine
CID 43449567
N-(8-aminoquinolin-5-yl)-3-(furan-2-yl)propanamide
CID 104826392
N-(8-aminoquinolin-5-yl)-3-methoxy-3-methylbutanamide
CID 103017990
N-(8-aminoquinolin-5-yl)pyridine-2-carboxamide
CID 104826471
N-(8-aminoquinolin-5-yl)-2-methoxy-2-methylpropanamide
CID 103017992
N-(2-acetamidophenyl)-3-cyclopentylpropanamide
CID 976246
3-cyclopentyl-N-[2-(hydroxymethyl)phenyl]propanamide
CID 60653813
N-(5-amino-2,4-difluorophenyl)-3-cyclohexylpropanamide
CID 43549850
N-(8-aminoquinolin-5-yl)-4-iodobenzamide
CID 104826395
N-(8-aminoquinolin-5-yl)-2-propylpentanamide
CID 104826496

Frequently Asked Questions

What is the IUPAC name of N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide?
The IUPAC name of N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide (CID 104826466) is N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide.
What is the SMILES notation for N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide?
The canonical SMILES for N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide is Nc1ccc(NC(=O)CCC2CCCC2)c2cccnc12.
What is the InChIKey of N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide?
The InChIKey is UKRRXYABDLLKCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c18-14-8-9-15(13-6-3-11-19-17(13)14)20-16(21)10-7-12-4-1-2-5-12/h3,6,8-9,11-12H,1-2,4-5,7,10,18H2,(H,20,21).
What are the key properties of N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide?
N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide has a molecular weight of 283.37 g/mol, XLogP of 3.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-aminoquinolin-5-yl)-3-cyclopentylpropanamide is sourced from PubChem (CID 104826466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).