(1R)-1-quinolin-2-ylethanamine;hydrochloride

C11H13ClN2 — CID 171216934

IUPAC(1R)-1-quinolin-2-ylethanamine;hydrochloride
SMILESC[C@@H](N)c1ccc2ccccc2n1.Cl
InChIInChI=1S/C11H12N2.ClH/c1-8(12)10-7-6-9-4-2-3-5-11(9)13-10;/h2-8H,12H2,1H3;1H/t8-;/m1./s1
InChIKeyXTOCCYKRUBQGJB-DDWIOCJRSA-N
MW208.69 g/mol
LogP2.68
Rot. Bonds1

About (1R)-1-quinolin-2-ylethanamine;hydrochloride

(1R)-1-quinolin-2-ylethanamine;hydrochloride (PubChem CID 171216934) has the molecular formula C11H13ClN2 and a molecular weight of 208.69 g/mol. Its IUPAC name is (1R)-1-quinolin-2-ylethanamine;hydrochloride.

Molecular Properties

Compound Name(1R)-1-quinolin-2-ylethanamine;hydrochloride
PubChem CID171216934
Molecular FormulaC11H13ClN2
Molecular Weight208.69 g/mol
Exact Mass208.08
IUPAC Name(1R)-1-quinolin-2-ylethanamine;hydrochloride
SMILESC[C@@H](N)c1ccc2ccccc2n1.Cl
InChIInChI=1S/C11H12N2.ClH/c1-8(12)10-7-6-9-4-2-3-5-11(9)13-10;/h2-8H,12H2,1H3;1H/t8-;/m1./s1
InChIKeyXTOCCYKRUBQGJB-DDWIOCJRSA-N
XLogP2.68
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.69
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-quinolin-2-ylethanamine;hydrochloride
CID 171236571
(1S)-1-quinolin-2-ylpropan-1-amine;hydrochloride
CID 171236572
methane;2-propan-2-ylquinoline
CID 161334581
ethane;2-propan-2-ylquinoline
CID 142538504
2-[(1R)-1-fluoroethyl]quinoline
CID 146161668
amino(quinolin-2-yl)methanol
CID 154237779
2-(1-chloroethyl)quinoline
CID 14750485
3-methyl-1-quinolin-2-ylpentan-1-amine
CID 63222429
2-amino-1-quinolin-2-ylbutan-1-ol
CID 64955097
methyl (2R)-2-amino-2-quinolin-2-ylacetate
CID 131435940
(R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride
CID 171216952
(1R)-1-quinolin-2-ylbutane-1,4-diamine
CID 171216930

Frequently Asked Questions

What is the IUPAC name of (1R)-1-quinolin-2-ylethanamine;hydrochloride?
The IUPAC name of (1R)-1-quinolin-2-ylethanamine;hydrochloride (CID 171216934) is (1R)-1-quinolin-2-ylethanamine;hydrochloride.
What is the SMILES notation for (1R)-1-quinolin-2-ylethanamine;hydrochloride?
The canonical SMILES for (1R)-1-quinolin-2-ylethanamine;hydrochloride is C[C@@H](N)c1ccc2ccccc2n1.Cl.
What is the InChIKey of (1R)-1-quinolin-2-ylethanamine;hydrochloride?
The InChIKey is XTOCCYKRUBQGJB-DDWIOCJRSA-N. The full InChI is InChI=1S/C11H12N2.ClH/c1-8(12)10-7-6-9-4-2-3-5-11(9)13-10;/h2-8H,12H2,1H3;1H/t8-;/m1./s1.
What are the key properties of (1R)-1-quinolin-2-ylethanamine;hydrochloride?
(1R)-1-quinolin-2-ylethanamine;hydrochloride has a molecular weight of 208.69 g/mol, XLogP of 2.68, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-quinolin-2-ylethanamine;hydrochloride is sourced from PubChem (CID 171216934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).