4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide

C23H17N5O2 — CID 155547712

IUPAC4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide
SMILESNC(=O)c1cnc2c(-c3cc(Oc4ccccc4)c4cn[nH]c4c3)cccc2c1N
InChIInChI=1S/C23H17N5O2/c24-21-16-8-4-7-15(22(16)26-11-18(21)23(25)29)13-9-19-17(12-27-28-19)20(10-13)30-14-5-2-1-3-6-14/h1-12H,(H2,24,26)(H2,25,29)(H,27,28)
InChIKeyPWCFGBVXLCFBKF-UHFFFAOYSA-N
MW395.42 g/mol
LogP4.25
Rot. Bonds4

About 4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide

4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide (PubChem CID 155547712) has the molecular formula C23H17N5O2 and a molecular weight of 395.42 g/mol. Its IUPAC name is 4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide.

Molecular Properties

Compound Name4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide
PubChem CID155547712
Molecular FormulaC23H17N5O2
Molecular Weight395.42 g/mol
Exact Mass395.14
IUPAC Name4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide
SMILESNC(=O)c1cnc2c(-c3cc(Oc4ccccc4)c4cn[nH]c4c3)cccc2c1N
InChIInChI=1S/C23H17N5O2/c24-21-16-8-4-7-15(22(16)26-11-18(21)23(25)29)13-9-19-17(12-27-28-19)20(10-13)30-14-5-2-1-3-6-14/h1-12H,(H2,24,26)(H2,25,29)(H,27,28)
InChIKeyPWCFGBVXLCFBKF-UHFFFAOYSA-N
XLogP4.25
TPSA119.91 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.42
LogP ≤ 54.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide 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-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide?
The IUPAC name of 4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide (CID 155547712) is 4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide.
What is the SMILES notation for 4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide?
The canonical SMILES for 4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide is NC(=O)c1cnc2c(-c3cc(Oc4ccccc4)c4cn[nH]c4c3)cccc2c1N.
What is the InChIKey of 4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide?
The InChIKey is PWCFGBVXLCFBKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N5O2/c24-21-16-8-4-7-15(22(16)26-11-18(21)23(25)29)13-9-19-17(12-27-28-19)20(10-13)30-14-5-2-1-3-6-14/h1-12H,(H2,24,26)(H2,25,29)(H,27,28).
What are the key properties of 4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide?
4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide has a molecular weight of 395.42 g/mol, XLogP of 4.25, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-8-(4-phenoxy-1H-indazol-6-yl)quinoline-3-carboxamide is sourced from PubChem (CID 155547712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).