4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine

C20H18N4O — CID 167350454

IUPAC4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine
SMILESc1ccc2nc(-c3n[nH]c4ccc(N5CCOCC5)cc34)ccc2c1
InChIInChI=1S/C20H18N4O/c1-2-4-17-14(3-1)5-7-19(21-17)20-16-13-15(6-8-18(16)22-23-20)24-9-11-25-12-10-24/h1-8,13H,9-12H2,(H,22,23)
InChIKeyDQOHOSKYQIEMSS-UHFFFAOYSA-N
MW330.39 g/mol
LogP3.61
Rot. Bonds2

About 4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine

4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine (PubChem CID 167350454) has the molecular formula C20H18N4O and a molecular weight of 330.39 g/mol. Its IUPAC name is 4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine.

Molecular Properties

Compound Name4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine
PubChem CID167350454
Molecular FormulaC20H18N4O
Molecular Weight330.39 g/mol
Exact Mass330.15
IUPAC Name4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine
SMILESc1ccc2nc(-c3n[nH]c4ccc(N5CCOCC5)cc34)ccc2c1
InChIInChI=1S/C20H18N4O/c1-2-4-17-14(3-1)5-7-19(21-17)20-16-13-15(6-8-18(16)22-23-20)24-9-11-25-12-10-24/h1-8,13H,9-12H2,(H,22,23)
InChIKeyDQOHOSKYQIEMSS-UHFFFAOYSA-N
XLogP3.61
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine 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 4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine?
The IUPAC name of 4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine (CID 167350454) is 4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine.
What is the SMILES notation for 4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine?
The canonical SMILES for 4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine is c1ccc2nc(-c3n[nH]c4ccc(N5CCOCC5)cc34)ccc2c1.
What is the InChIKey of 4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine?
The InChIKey is DQOHOSKYQIEMSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O/c1-2-4-17-14(3-1)5-7-19(21-17)20-16-13-15(6-8-18(16)22-23-20)24-9-11-25-12-10-24/h1-8,13H,9-12H2,(H,22,23).
What are the key properties of 4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine?
4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine has a molecular weight of 330.39 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-quinolin-2-yl-1H-indazol-5-yl)morpholine is sourced from PubChem (CID 167350454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).