8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline

C15H15N3O — CID 82088189

IUPAC8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline
SMILESCc1cc(CCOc2cccc3cccnc23)n[nH]1
InChIInChI=1S/C15H15N3O/c1-11-10-13(18-17-11)7-9-19-14-6-2-4-12-5-3-8-16-15(12)14/h2-6,8,10H,7,9H2,1H3,(H,17,18)
InChIKeyFYCUIKDJFMCUHE-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.89
Rot. Bonds4

About 8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline

8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline (PubChem CID 82088189) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline.

Molecular Properties

Compound Name8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline
PubChem CID82088189
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline
SMILESCc1cc(CCOc2cccc3cccnc23)n[nH]1
InChIInChI=1S/C15H15N3O/c1-11-10-13(18-17-11)7-9-19-14-6-2-4-12-5-3-8-16-15(12)14/h2-6,8,10H,7,9H2,1H3,(H,17,18)
InChIKeyFYCUIKDJFMCUHE-UHFFFAOYSA-N
XLogP2.89
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine
CID 82088442
1-methyl-3-(2-quinolin-8-yloxyethyl)pyrazol-5-amine
CID 82092564
5-(quinolin-8-yloxymethyl)-1H-pyrazol-3-amine
CID 82084486
8-[3-(2,4-dimethylphenoxy)propoxy]quinoline
CID 3611795
2-quinolin-8-yloxyethanamine
CID 17174906
8-(chloromethoxy)quinoline
CID 79531226
8-[4-(4-chloro-2-methylphenoxy)butoxy]quinoline
CID 2289108
4,5,6-trimethyl-N-(2-quinolin-8-yloxyethyl)pyrimidin-2-amine
CID 163313189
8-(6-chlorohexoxy)quinoline
CID 62228191
8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline
CID 24849053
2-ethoxyethyl 2-quinolin-8-yloxyacetate
CID 71408852
2-quinolin-8-yloxyethylhydrazine
CID 82126133

Frequently Asked Questions

What is the IUPAC name of 8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline?
The IUPAC name of 8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline (CID 82088189) is 8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline.
What is the SMILES notation for 8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline?
The canonical SMILES for 8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline is Cc1cc(CCOc2cccc3cccnc23)n[nH]1.
What is the InChIKey of 8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline?
The InChIKey is FYCUIKDJFMCUHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-11-10-13(18-17-11)7-9-19-14-6-2-4-12-5-3-8-16-15(12)14/h2-6,8,10H,7,9H2,1H3,(H,17,18).
What are the key properties of 8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline?
8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline has a molecular weight of 253.31 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline is sourced from PubChem (CID 82088189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).