7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine

C16H11ClN4 — CID 57450018

IUPAC7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine
SMILESClc1ccc2c(Nc3ccc4cn[nH]c4c3)ccnc2c1
InChIInChI=1S/C16H11ClN4/c17-11-2-4-13-14(5-6-18-16(13)7-11)20-12-3-1-10-9-19-21-15(10)8-12/h1-9H,(H,18,20)(H,19,21)
InChIKeyJTJIUQOKVNYXAQ-UHFFFAOYSA-N
MW294.75 g/mol
LogP4.51
Rot. Bonds2

About 7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine

7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine (PubChem CID 57450018) has the molecular formula C16H11ClN4 and a molecular weight of 294.75 g/mol. Its IUPAC name is 7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine.

Molecular Properties

Compound Name7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine
PubChem CID57450018
Molecular FormulaC16H11ClN4
Molecular Weight294.75 g/mol
Exact Mass294.07
IUPAC Name7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine
SMILESClc1ccc2c(Nc3ccc4cn[nH]c4c3)ccnc2c1
InChIInChI=1S/C16H11ClN4/c17-11-2-4-13-14(5-6-18-16(13)7-11)20-12-3-1-10-9-19-21-15(10)8-12/h1-9H,(H,18,20)(H,19,21)
InChIKeyJTJIUQOKVNYXAQ-UHFFFAOYSA-N
XLogP4.51
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.75
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine 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-chloro-N-(1H-indazol-6-yl)quinolin-4-amine?
The IUPAC name of 7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine (CID 57450018) is 7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine.
What is the SMILES notation for 7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine?
The canonical SMILES for 7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine is Clc1ccc2c(Nc3ccc4cn[nH]c4c3)ccnc2c1.
What is the InChIKey of 7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine?
The InChIKey is JTJIUQOKVNYXAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClN4/c17-11-2-4-13-14(5-6-18-16(13)7-11)20-12-3-1-10-9-19-21-15(10)8-12/h1-9H,(H,18,20)(H,19,21).
What are the key properties of 7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine?
7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine has a molecular weight of 294.75 g/mol, XLogP of 4.51, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-(1H-indazol-6-yl)quinolin-4-amine is sourced from PubChem (CID 57450018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).