5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine

C14H14N4O — CID 82088442

IUPAC5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine
SMILESNc1cc(CCOc2cccc3cccnc23)[nH]n1
InChIInChI=1S/C14H14N4O/c15-13-9-11(17-18-13)6-8-19-12-5-1-3-10-4-2-7-16-14(10)12/h1-5,7,9H,6,8H2,(H3,15,17,18)
InChIKeyPFHNPEPATFXEOV-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.16
Rot. Bonds4

About 5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine

5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine (PubChem CID 82088442) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine
PubChem CID82088442
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine
SMILESNc1cc(CCOc2cccc3cccnc23)[nH]n1
InChIInChI=1S/C14H14N4O/c15-13-9-11(17-18-13)6-8-19-12-5-1-3-10-4-2-7-16-14(10)12/h1-5,7,9H,6,8H2,(H3,15,17,18)
InChIKeyPFHNPEPATFXEOV-UHFFFAOYSA-N
XLogP2.16
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(quinolin-8-yloxymethyl)-1H-pyrazol-3-amine
CID 82084486
8-[2-(5-methyl-1H-pyrazol-3-yl)ethoxy]quinoline
CID 82088189
2-quinolin-8-yloxyethanamine
CID 17174906
1-methyl-3-(2-quinolin-8-yloxyethyl)pyrazol-5-amine
CID 82092564
2-quinolin-8-yloxyethylhydrazine
CID 82126133
8-[4-(2-fluorophenoxy)butoxy]quinoline
CID 4302402
8-(6-chlorohexoxy)quinoline
CID 62228191
2-ethoxyethyl 2-quinolin-8-yloxyacetate
CID 71408852
8-(chloromethoxy)quinoline
CID 79531226
2-methoxyethyl 2-quinolin-8-yloxyacetate
CID 71408859
8-(2,2,2-trifluoroethoxy)quinoline
CID 70258854
8-[2-(2,6-dichlorophenoxy)ethoxy]quinoline
CID 2283916

Frequently Asked Questions

What is the IUPAC name of 5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine (CID 82088442) is 5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine is Nc1cc(CCOc2cccc3cccnc23)[nH]n1.
What is the InChIKey of 5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine?
The InChIKey is PFHNPEPATFXEOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c15-13-9-11(17-18-13)6-8-19-12-5-1-3-10-4-2-7-16-14(10)12/h1-5,7,9H,6,8H2,(H3,15,17,18).
What are the key properties of 5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine?
5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine has a molecular weight of 254.29 g/mol, XLogP of 2.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-quinolin-8-yloxyethyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 82088442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).