8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline

C16H21N3O — CID 24849053

IUPAC8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline
SMILESCN1CCN(CCOc2cccc3cccnc23)CC1
InChIInChI=1S/C16H21N3O/c1-18-8-10-19(11-9-18)12-13-20-15-6-2-4-14-5-3-7-17-16(14)15/h2-7H,8-13H2,1H3
InChIKeyFQJYECGAPXNICM-UHFFFAOYSA-N
MW271.36 g/mol
LogP1.86
Rot. Bonds4

About 8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline

8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline (PubChem CID 24849053) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline.

Molecular Properties

Compound Name8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline
PubChem CID24849053
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline
SMILESCN1CCN(CCOc2cccc3cccnc23)CC1
InChIInChI=1S/C16H21N3O/c1-18-8-10-19(11-9-18)12-13-20-15-6-2-4-14-5-3-7-17-16(14)15/h2-7H,8-13H2,1H3
InChIKeyFQJYECGAPXNICM-UHFFFAOYSA-N
XLogP1.86
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

8-(2-piperazin-1-ylethoxy)quinoline
CID 24849055
2-(4-methyl-1,4-diazepan-1-yl)-N-(2-quinolin-8-yloxyethyl)acetamide
CID 50949310
8-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]quinoline
CID 50943740
8-(2-imidazol-1-ylethoxy)quinoline
CID 24849052
2-quinolin-8-yloxyethanamine
CID 17174906
1-[2-(2-butoxyphenoxy)ethyl]-4-methylpiperazine;hydrochloride
CID 2996491
8-(6-chlorohexoxy)quinoline
CID 62228191
8-(4-methylpiperazin-1-yl)quinoline
CID 20701166
iodocopper;1,10-phenanthroline;bis(tris[(4-methylpiperazin-1-yl)methyl]phosphane)
CID 86573159
1-(4-ethylpiperazin-1-yl)-2-quinolin-8-yloxyethanone
CID 110849960
2-quinolin-8-yloxyethylhydrazine
CID 82126133
8-(chloromethoxy)quinoline
CID 79531226

Frequently Asked Questions

What is the IUPAC name of 8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline?
The IUPAC name of 8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline (CID 24849053) is 8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline.
What is the SMILES notation for 8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline?
The canonical SMILES for 8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline is CN1CCN(CCOc2cccc3cccnc23)CC1.
What is the InChIKey of 8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline?
The InChIKey is FQJYECGAPXNICM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-18-8-10-19(11-9-18)12-13-20-15-6-2-4-14-5-3-7-17-16(14)15/h2-7H,8-13H2,1H3.
What are the key properties of 8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline?
8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline has a molecular weight of 271.36 g/mol, XLogP of 1.86, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline is sourced from PubChem (CID 24849053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).