6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine

C15H16N4O — CID 116800507

IUPAC6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine
SMILESCC(C)n1cc(Oc2ccc3ncccc3c2N)cn1
InChIInChI=1S/C15H16N4O/c1-10(2)19-9-11(8-18-19)20-14-6-5-13-12(15(14)16)4-3-7-17-13/h3-10H,16H2,1-2H3
InChIKeySPYFACOWRPIRNY-UHFFFAOYSA-N
MW268.32 g/mol
LogP3.39
Rot. Bonds3

About 6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine

6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine (PubChem CID 116800507) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine.

Molecular Properties

Compound Name6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine
PubChem CID116800507
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine
SMILESCC(C)n1cc(Oc2ccc3ncccc3c2N)cn1
InChIInChI=1S/C15H16N4O/c1-10(2)19-9-11(8-18-19)20-14-6-5-13-12(15(14)16)4-3-7-17-13/h3-10H,16H2,1-2H3
InChIKeySPYFACOWRPIRNY-UHFFFAOYSA-N
XLogP3.39
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(3-methoxyphenoxy)quinolin-5-amine
CID 43809791
6-(4-bromo-3,5-dimethylphenoxy)quinolin-5-amine
CID 107722598
2-methylsulfonyl-6-(1-propan-2-ylpyrazol-4-yl)oxyaniline
CID 116800626
4-(1-propan-2-ylpyrazol-4-yl)oxy-2,1,3-benzoxadiazol-7-amine
CID 116800519
4-bromo-2-(1-propan-2-ylpyrazol-4-yl)oxyaniline
CID 116800549
4,5-dimethoxy-2-(1-propan-2-ylpyrazol-4-yl)oxyaniline
CID 116800610
4-(1-propan-2-ylpyrazol-4-yl)oxyquinoline-3-carbonitrile
CID 116801257
5-methylsulfonyl-2-(1-propan-2-ylpyrazol-4-yl)oxyaniline
CID 116800505
3-(1-propan-2-ylpyrazol-4-yl)oxypyrazin-2-amine
CID 102988441
3-(chloromethyl)-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine
CID 116802722
(1R)-1-[3-bromo-4-(1-propan-2-ylpyrazol-4-yl)oxyphenyl]ethanamine
CID 104893574
6-(2-iodophenoxy)quinolin-5-amine
CID 43809889

Frequently Asked Questions

What is the IUPAC name of 6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine?
The IUPAC name of 6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine (CID 116800507) is 6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine.
What is the SMILES notation for 6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine?
The canonical SMILES for 6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine is CC(C)n1cc(Oc2ccc3ncccc3c2N)cn1.
What is the InChIKey of 6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine?
The InChIKey is SPYFACOWRPIRNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-10(2)19-9-11(8-18-19)20-14-6-5-13-12(15(14)16)4-3-7-17-13/h3-10H,16H2,1-2H3.
What are the key properties of 6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine?
6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine has a molecular weight of 268.32 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-5-amine is sourced from PubChem (CID 116800507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).