7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline

C25H19N3O — CID 70687764

IUPAC7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline
SMILESc1ccc(COc2ccc3c(-c4cnn(-c5ccccc5)c4)ccnc3c2)cc1
InChIInChI=1S/C25H19N3O/c1-3-7-19(8-4-1)18-29-22-11-12-24-23(13-14-26-25(24)15-22)20-16-27-28(17-20)21-9-5-2-6-10-21/h1-17H,18H2
InChIKeyULOSWQLZXFWNJV-UHFFFAOYSA-N
MW377.45 g/mol
LogP5.67
Rot. Bonds5

About 7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline

7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline (PubChem CID 70687764) has the molecular formula C25H19N3O and a molecular weight of 377.45 g/mol. Its IUPAC name is 7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline.

Molecular Properties

Compound Name7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline
PubChem CID70687764
Molecular FormulaC25H19N3O
Molecular Weight377.45 g/mol
Exact Mass377.15
IUPAC Name7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline
SMILESc1ccc(COc2ccc3c(-c4cnn(-c5ccccc5)c4)ccnc3c2)cc1
InChIInChI=1S/C25H19N3O/c1-3-7-19(8-4-1)18-29-22-11-12-24-23(13-14-26-25(24)15-22)20-16-27-28(17-20)21-9-5-2-6-10-21/h1-17H,18H2
InChIKeyULOSWQLZXFWNJV-UHFFFAOYSA-N
XLogP5.67
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.45
LogP ≤ 55.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline 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 7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline?
The IUPAC name of 7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline (CID 70687764) is 7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline.
What is the SMILES notation for 7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline?
The canonical SMILES for 7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline is c1ccc(COc2ccc3c(-c4cnn(-c5ccccc5)c4)ccnc3c2)cc1.
What is the InChIKey of 7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline?
The InChIKey is ULOSWQLZXFWNJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19N3O/c1-3-7-19(8-4-1)18-29-22-11-12-24-23(13-14-26-25(24)15-22)20-16-27-28(17-20)21-9-5-2-6-10-21/h1-17H,18H2.
What are the key properties of 7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline?
7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline has a molecular weight of 377.45 g/mol, XLogP of 5.67, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenylmethoxy-4-(1-phenylpyrazol-4-yl)quinoline is sourced from PubChem (CID 70687764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).