2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine

C12H12Cl2N2 — CID 82245346

IUPAC2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine
SMILESCc1nc2c(Cl)ccc(Cl)c2cc1CCN
InChIInChI=1S/C12H12Cl2N2/c1-7-8(4-5-15)6-9-10(13)2-3-11(14)12(9)16-7/h2-3,6H,4-5,15H2,1H3
InChIKeyKRZUODZKKNUBHC-UHFFFAOYSA-N
MW255.15 g/mol
LogP3.35
Rot. Bonds2

About 2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine

2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine (PubChem CID 82245346) has the molecular formula C12H12Cl2N2 and a molecular weight of 255.15 g/mol. Its IUPAC name is 2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine.

Molecular Properties

Compound Name2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine
PubChem CID82245346
Molecular FormulaC12H12Cl2N2
Molecular Weight255.15 g/mol
Exact Mass254.04
IUPAC Name2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine
SMILESCc1nc2c(Cl)ccc(Cl)c2cc1CCN
InChIInChI=1S/C12H12Cl2N2/c1-7-8(4-5-15)6-9-10(13)2-3-11(14)12(9)16-7/h2-3,6H,4-5,15H2,1H3
InChIKeyKRZUODZKKNUBHC-UHFFFAOYSA-N
XLogP3.35
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.15
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(6,8-dichloro-2-methylquinolin-3-yl)ethanamine
CID 82245350
2-(8-chloro-4-methylquinolin-2-yl)ethanamine
CID 82575547
(5-chloro-3,8-dimethylquinolin-2-yl)methanamine
CID 82242202
2,5-dichloro-3-ethyl-8-methylquinoline
CID 39346000
2-(2-aminoethyl)-6-chloro-4-methylphenol
CID 83876612
2-(3-chloro-6-methyl-2-pyridinyl)ethanamine
CID 83874064
2-[3-chloro-2-(3-methylphenoxy)phenyl]ethanamine
CID 114070200
2-(6-chloro-2,8-dimethylquinolin-4-yl)ethanamine
CID 82575608
2-(5-chloro-4,8-dimethylquinolin-2-yl)ethanamine
CID 82575558
2-(6-chloro-4-methylquinolin-8-yl)ethanamine
CID 82575531
2-(4-chloro-8-methoxy-2-methylquinolin-5-yl)ethanamine
CID 82575640
5-chloro-8-methyl-N,3-dipropylquinolin-2-amine
CID 55223167

Frequently Asked Questions

What is the IUPAC name of 2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine?
The IUPAC name of 2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine (CID 82245346) is 2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine.
What is the SMILES notation for 2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine?
The canonical SMILES for 2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine is Cc1nc2c(Cl)ccc(Cl)c2cc1CCN.
What is the InChIKey of 2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine?
The InChIKey is KRZUODZKKNUBHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12Cl2N2/c1-7-8(4-5-15)6-9-10(13)2-3-11(14)12(9)16-7/h2-3,6H,4-5,15H2,1H3.
What are the key properties of 2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine?
2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine has a molecular weight of 255.15 g/mol, XLogP of 3.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,8-dichloro-2-methylquinolin-3-yl)ethanamine is sourced from PubChem (CID 82245346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).