5-chloro-8-(5-chloropentoxy)quinoline

C14H15Cl2NO — CID 43348411

IUPAC5-chloro-8-(5-chloropentoxy)quinoline
SMILESClCCCCCOc1ccc(Cl)c2cccnc12
InChIInChI=1S/C14H15Cl2NO/c15-8-2-1-3-10-18-13-7-6-12(16)11-5-4-9-17-14(11)13/h4-7,9H,1-3,8,10H2
InChIKeyKHBCFYQWBJEINR-UHFFFAOYSA-N
MW284.19 g/mol
LogP4.68
Rot. Bonds6

About 5-chloro-8-(5-chloropentoxy)quinoline

5-chloro-8-(5-chloropentoxy)quinoline (PubChem CID 43348411) has the molecular formula C14H15Cl2NO and a molecular weight of 284.19 g/mol. Its IUPAC name is 5-chloro-8-(5-chloropentoxy)quinoline.

Molecular Properties

Compound Name5-chloro-8-(5-chloropentoxy)quinoline
PubChem CID43348411
Molecular FormulaC14H15Cl2NO
Molecular Weight284.19 g/mol
Exact Mass283.05
IUPAC Name5-chloro-8-(5-chloropentoxy)quinoline
SMILESClCCCCCOc1ccc(Cl)c2cccnc12
InChIInChI=1S/C14H15Cl2NO/c15-8-2-1-3-10-18-13-7-6-12(16)11-5-4-9-17-14(11)13/h4-7,9H,1-3,8,10H2
InChIKeyKHBCFYQWBJEINR-UHFFFAOYSA-N
XLogP4.68
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.19
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-chloro-8-(6-chlorohexoxy)quinoline
CID 55193642
5-(5-chloroquinolin-8-yl)oxypentan-1-amine
CID 54965610
2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine
CID 146013303
N-[(4-chlorophenyl)methyl]-4-(5-chloroquinolin-8-yl)oxybutan-1-amine
CID 71517727
8-(6-chlorohexoxy)quinoline
CID 62228191
CID 12945983
CID 12945983
4-[2-(5-chloroquinolin-8-yl)oxyethoxy]benzonitrile
CID 2216428
O-dodecyl 2-(5-chloroquinolin-8-yl)oxyethanethioate
CID 19839509
8-[4-(2,6-dichlorophenoxy)butoxy]quinoline
CID 2284830
methyl 2-(5-chloroquinolin-8-yl)oxyacetate
CID 15257198
4-[4-[3-(5-chloroquinolin-8-yl)oxypropoxy]phenyl]butan-2-one
CID 2216411
6-(5-aminoquinolin-8-yl)oxyhexan-1-ol
CID 107702002

Frequently Asked Questions

What is the IUPAC name of 5-chloro-8-(5-chloropentoxy)quinoline?
The IUPAC name of 5-chloro-8-(5-chloropentoxy)quinoline (CID 43348411) is 5-chloro-8-(5-chloropentoxy)quinoline.
What is the SMILES notation for 5-chloro-8-(5-chloropentoxy)quinoline?
The canonical SMILES for 5-chloro-8-(5-chloropentoxy)quinoline is ClCCCCCOc1ccc(Cl)c2cccnc12.
What is the InChIKey of 5-chloro-8-(5-chloropentoxy)quinoline?
The InChIKey is KHBCFYQWBJEINR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Cl2NO/c15-8-2-1-3-10-18-13-7-6-12(16)11-5-4-9-17-14(11)13/h4-7,9H,1-3,8,10H2.
What are the key properties of 5-chloro-8-(5-chloropentoxy)quinoline?
5-chloro-8-(5-chloropentoxy)quinoline has a molecular weight of 284.19 g/mol, XLogP of 4.68, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-8-(5-chloropentoxy)quinoline is sourced from PubChem (CID 43348411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).