[2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol

C16H17N3O2 — CID 116802650

IUPAC[2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol
SMILESCCCn1cc(Oc2cc(CO)c3ccccc3n2)cn1
InChIInChI=1S/C16H17N3O2/c1-2-7-19-10-13(9-17-19)21-16-8-12(11-20)14-5-3-4-6-15(14)18-16/h3-6,8-10,20H,2,7,11H2,1H3
InChIKeyHWZLHMFLRMBPJQ-UHFFFAOYSA-N
MW283.33 g/mol
LogP3.13
Rot. Bonds5

About [2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol

[2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol (PubChem CID 116802650) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is [2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol.

Molecular Properties

Compound Name[2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol
PubChem CID116802650
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name[2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol
SMILESCCCn1cc(Oc2cc(CO)c3ccccc3n2)cn1
InChIInChI=1S/C16H17N3O2/c1-2-7-19-10-13(9-17-19)21-16-8-12(11-20)14-5-3-4-6-15(14)18-16/h3-6,8-10,20H,2,7,11H2,1H3
InChIKeyHWZLHMFLRMBPJQ-UHFFFAOYSA-N
XLogP3.13
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(1-methylpyrazol-4-yl)oxyquinolin-4-yl]methanol
CID 116793268
1-[2-(1-ethylpyrazol-4-yl)oxyquinolin-4-yl]-N-methylmethanamine
CID 116802845
[6-(1-propylpyrazol-4-yl)oxypyridazin-3-yl]methanol
CID 116802649
[4-chloro-2-(1-propylpyrazol-4-yl)oxyphenyl]methanol
CID 114846259
[2-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-4-yl]methanamine
CID 116800179
2-propyl-6-(1-propylpyrazol-4-yl)oxypyridine-4-carboxylic acid
CID 116800823
1-[2-(1-propylpyrazol-4-yl)oxyphenyl]propan-1-one
CID 116801605
[1-(1-propylpyrazol-4-yl)oxyisoquinolin-4-yl]methanamine
CID 106777567
2-(1-propylpyrazol-4-yl)oxypyridin-4-amine
CID 116800439
N-[[6-(1-propylpyrazol-4-yl)oxypyrazin-2-yl]methyl]ethanamine
CID 116802960
[5-(1-propylpyrazol-4-yl)oxypyrazin-2-yl]methanamine
CID 116800165
[1-(1-ethylpyrazol-4-yl)oxyisoquinolin-4-yl]methanol
CID 106768860

Frequently Asked Questions

What is the IUPAC name of [2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol?
The IUPAC name of [2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol (CID 116802650) is [2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol.
What is the SMILES notation for [2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol?
The canonical SMILES for [2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol is CCCn1cc(Oc2cc(CO)c3ccccc3n2)cn1.
What is the InChIKey of [2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol?
The InChIKey is HWZLHMFLRMBPJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-2-7-19-10-13(9-17-19)21-16-8-12(11-20)14-5-3-4-6-15(14)18-16/h3-6,8-10,20H,2,7,11H2,1H3.
What are the key properties of [2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol?
[2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol has a molecular weight of 283.33 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-propylpyrazol-4-yl)oxyquinolin-4-yl]methanol is sourced from PubChem (CID 116802650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).