6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride

C21H19ClN4 — CID 166059179

IUPAC6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride
SMILESCCc1nc(N)ccc1-c1cccc2ccc(-c3ccccn3)nc12.Cl
InChIInChI=1S/C21H18N4.ClH/c1-2-17-15(10-12-20(22)24-17)16-7-5-6-14-9-11-19(25-21(14)16)18-8-3-4-13-23-18;/h3-13H,2H2,1H3,(H2,22,24);1H
InChIKeyDHDGPRCLIIQPRC-UHFFFAOYSA-N
MW362.86 g/mol
LogP4.93
Rot. Bonds3

About 6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride

6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride (PubChem CID 166059179) has the molecular formula C21H19ClN4 and a molecular weight of 362.86 g/mol. Its IUPAC name is 6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride.

Molecular Properties

Compound Name6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride
PubChem CID166059179
Molecular FormulaC21H19ClN4
Molecular Weight362.86 g/mol
Exact Mass362.13
IUPAC Name6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride
SMILESCCc1nc(N)ccc1-c1cccc2ccc(-c3ccccn3)nc12.Cl
InChIInChI=1S/C21H18N4.ClH/c1-2-17-15(10-12-20(22)24-17)16-7-5-6-14-9-11-19(25-21(14)16)18-8-3-4-13-23-18;/h3-13H,2H2,1H3,(H2,22,24);1H
InChIKeyDHDGPRCLIIQPRC-UHFFFAOYSA-N
XLogP4.93
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.86
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride?
The IUPAC name of 6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride (CID 166059179) is 6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride.
What is the SMILES notation for 6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride?
The canonical SMILES for 6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride is CCc1nc(N)ccc1-c1cccc2ccc(-c3ccccn3)nc12.Cl.
What is the InChIKey of 6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride?
The InChIKey is DHDGPRCLIIQPRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4.ClH/c1-2-17-15(10-12-20(22)24-17)16-7-5-6-14-9-11-19(25-21(14)16)18-8-3-4-13-23-18;/h3-13H,2H2,1H3,(H2,22,24);1H.
What are the key properties of 6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride?
6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride has a molecular weight of 362.86 g/mol, XLogP of 4.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride is sourced from PubChem (CID 166059179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).