(1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol

C15H16N4O — CID 107357558

IUPAC(1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol
SMILESCCCn1cc(C(O)c2cnc3ccccc3n2)cn1
InChIInChI=1S/C15H16N4O/c1-2-7-19-10-11(8-17-19)15(20)14-9-16-12-5-3-4-6-13(12)18-14/h3-6,8-10,15,20H,2,7H2,1H3
InChIKeyLBLGZPWSDFQXSS-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.32
Rot. Bonds4

About (1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol

(1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol (PubChem CID 107357558) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is (1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol.

Molecular Properties

Compound Name(1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol
PubChem CID107357558
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name(1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol
SMILESCCCn1cc(C(O)c2cnc3ccccc3n2)cn1
InChIInChI=1S/C15H16N4O/c1-2-7-19-10-11(8-17-19)15(20)14-9-16-12-5-3-4-6-13(12)18-14/h3-6,8-10,15,20H,2,7H2,1H3
InChIKeyLBLGZPWSDFQXSS-UHFFFAOYSA-N
XLogP2.32
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol?
The IUPAC name of (1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol (CID 107357558) is (1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol.
What is the SMILES notation for (1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol?
The canonical SMILES for (1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol is CCCn1cc(C(O)c2cnc3ccccc3n2)cn1.
What is the InChIKey of (1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol?
The InChIKey is LBLGZPWSDFQXSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-2-7-19-10-11(8-17-19)15(20)14-9-16-12-5-3-4-6-13(12)18-14/h3-6,8-10,15,20H,2,7H2,1H3.
What are the key properties of (1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol?
(1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol has a molecular weight of 268.32 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-propylpyrazol-4-yl)-quinoxalin-2-ylmethanol is sourced from PubChem (CID 107357558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).