2-quinolin-3-ylethanamine;hydrochloride

C11H13ClN2 — CID 68724239

IUPAC2-quinolin-3-ylethanamine;hydrochloride
SMILESCl.NCCc1cnc2ccccc2c1
InChIInChI=1S/C11H12N2.ClH/c12-6-5-9-7-10-3-1-2-4-11(10)13-8-9;/h1-4,7-8H,5-6,12H2;1H
InChIKeyAPBJFFDKVAIVJI-UHFFFAOYSA-N
MW208.69 g/mol
LogP2.16
Rot. Bonds2

About 2-quinolin-3-ylethanamine;hydrochloride

2-quinolin-3-ylethanamine;hydrochloride (PubChem CID 68724239) has the molecular formula C11H13ClN2 and a molecular weight of 208.69 g/mol. Its IUPAC name is 2-quinolin-3-ylethanamine;hydrochloride.

Molecular Properties

Compound Name2-quinolin-3-ylethanamine;hydrochloride
PubChem CID68724239
Molecular FormulaC11H13ClN2
Molecular Weight208.69 g/mol
Exact Mass208.08
IUPAC Name2-quinolin-3-ylethanamine;hydrochloride
SMILESCl.NCCc1cnc2ccccc2c1
InChIInChI=1S/C11H12N2.ClH/c12-6-5-9-7-10-3-1-2-4-11(10)13-8-9;/h1-4,7-8H,5-6,12H2;1H
InChIKeyAPBJFFDKVAIVJI-UHFFFAOYSA-N
XLogP2.16
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.69
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-quinolin-3-ylethanamine;hydrochloride?
The IUPAC name of 2-quinolin-3-ylethanamine;hydrochloride (CID 68724239) is 2-quinolin-3-ylethanamine;hydrochloride.
What is the SMILES notation for 2-quinolin-3-ylethanamine;hydrochloride?
The canonical SMILES for 2-quinolin-3-ylethanamine;hydrochloride is Cl.NCCc1cnc2ccccc2c1.
What is the InChIKey of 2-quinolin-3-ylethanamine;hydrochloride?
The InChIKey is APBJFFDKVAIVJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2.ClH/c12-6-5-9-7-10-3-1-2-4-11(10)13-8-9;/h1-4,7-8H,5-6,12H2;1H.
What are the key properties of 2-quinolin-3-ylethanamine;hydrochloride?
2-quinolin-3-ylethanamine;hydrochloride has a molecular weight of 208.69 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-quinolin-3-ylethanamine;hydrochloride is sourced from PubChem (CID 68724239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).