N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride

C22H17ClN4 — CID 44532202

IUPACN-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride
SMILESCl.c1ccc(-c2ccc3c(Nc4ccc5[nH]ccc5c4)ccnc3c2)nc1
InChIInChI=1S/C22H16N4.ClH/c1-2-10-23-19(3-1)15-4-6-18-21(9-12-25-22(18)14-15)26-17-5-7-20-16(13-17)8-11-24-20;/h1-14,24H,(H,25,26);1H
InChIKeyYAJZUEXWXAOCHA-UHFFFAOYSA-N
MW372.86 g/mol
LogP5.94
Rot. Bonds3

About N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride

N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride (PubChem CID 44532202) has the molecular formula C22H17ClN4 and a molecular weight of 372.86 g/mol. Its IUPAC name is N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride.

Molecular Properties

Compound NameN-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride
PubChem CID44532202
Molecular FormulaC22H17ClN4
Molecular Weight372.86 g/mol
Exact Mass372.11
IUPAC NameN-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride
SMILESCl.c1ccc(-c2ccc3c(Nc4ccc5[nH]ccc5c4)ccnc3c2)nc1
InChIInChI=1S/C22H16N4.ClH/c1-2-10-23-19(3-1)15-4-6-18-21(9-12-25-22(18)14-15)26-17-5-7-20-16(13-17)8-11-24-20;/h1-14,24H,(H,25,26);1H
InChIKeyYAJZUEXWXAOCHA-UHFFFAOYSA-N
XLogP5.94
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.86
LogP ≤ 55.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride?
The IUPAC name of N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride (CID 44532202) is N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride.
What is the SMILES notation for N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride?
The canonical SMILES for N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride is Cl.c1ccc(-c2ccc3c(Nc4ccc5[nH]ccc5c4)ccnc3c2)nc1.
What is the InChIKey of N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride?
The InChIKey is YAJZUEXWXAOCHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N4.ClH/c1-2-10-23-19(3-1)15-4-6-18-21(9-12-25-22(18)14-15)26-17-5-7-20-16(13-17)8-11-24-20;/h1-14,24H,(H,25,26);1H.
What are the key properties of N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride?
N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride has a molecular weight of 372.86 g/mol, XLogP of 5.94, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-5-yl)-7-pyridin-2-ylquinolin-4-amine;hydrochloride is sourced from PubChem (CID 44532202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).