(1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol

C17H19N3O — CID 105118165

IUPAC(1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol
SMILESCCc1cc(C(O)c2cccc3ncccc23)n(CC)n1
InChIInChI=1S/C17H19N3O/c1-3-12-11-16(20(4-2)19-12)17(21)14-7-5-9-15-13(14)8-6-10-18-15/h5-11,17,21H,3-4H2,1-2H3
InChIKeySYTUDHGFIAMRLU-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.10
Rot. Bonds4

About (1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol

(1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol (PubChem CID 105118165) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is (1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol.

Molecular Properties

Compound Name(1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol
PubChem CID105118165
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name(1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol
SMILESCCc1cc(C(O)c2cccc3ncccc23)n(CC)n1
InChIInChI=1S/C17H19N3O/c1-3-12-11-16(20(4-2)19-12)17(21)14-7-5-9-15-13(14)8-6-10-18-15/h5-11,17,21H,3-4H2,1-2H3
InChIKeySYTUDHGFIAMRLU-UHFFFAOYSA-N
XLogP3.10
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1,3-diethylpyrazol-5-yl)-isoquinolin-5-ylmethanol
CID 105094553
1-benzothiophen-7-yl-(1,3-diethylpyrazol-5-yl)methanol
CID 105119200
(4-chloro-2-fluorophenyl)-(1,3-diethylpyrazol-5-yl)methanol
CID 105119892
2-(2-ethyl-1,2,4-triazol-3-yl)-1-quinolin-5-ylethanol
CID 105109180
(1R)-1-quinolin-5-ylethanol
CID 86326294
2-methyl-1-quinolin-5-ylpentan-1-ol
CID 81216641
(1,3-diethylpyrazol-5-yl)-(3,4-difluorophenyl)methanol
CID 105096371
1-(1,3-diethylpyrazol-5-yl)-2-(3-fluorophenyl)ethanol
CID 105079038
2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol
CID 105112369
(3,5-dibromophenyl)-quinolin-5-ylmethanol
CID 107978579
2-quinolin-5-ylpentanoic acid
CID 83042751
(2,5-dimethylfuran-3-yl)-quinolin-5-ylmethanol
CID 115826245

Frequently Asked Questions

What is the IUPAC name of (1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol?
The IUPAC name of (1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol (CID 105118165) is (1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol.
What is the SMILES notation for (1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol?
The canonical SMILES for (1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol is CCc1cc(C(O)c2cccc3ncccc23)n(CC)n1.
What is the InChIKey of (1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol?
The InChIKey is SYTUDHGFIAMRLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-3-12-11-16(20(4-2)19-12)17(21)14-7-5-9-15-13(14)8-6-10-18-15/h5-11,17,21H,3-4H2,1-2H3.
What are the key properties of (1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol?
(1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol has a molecular weight of 281.36 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1,3-diethylpyrazol-5-yl)-quinolin-5-ylmethanol is sourced from PubChem (CID 105118165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).