7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine

C13H15Cl2N3 — CID 82249628

IUPAC7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine
SMILESCNCc1cc(N(C)C)c2ccc(Cl)c(Cl)c2n1
InChIInChI=1S/C13H15Cl2N3/c1-16-7-8-6-11(18(2)3)9-4-5-10(14)12(15)13(9)17-8/h4-6,16H,7H2,1-3H3
InChIKeyWYKWNJGDXYOIDY-UHFFFAOYSA-N
MW284.19 g/mol
LogP3.33
Rot. Bonds3

About 7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine

7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine (PubChem CID 82249628) has the molecular formula C13H15Cl2N3 and a molecular weight of 284.19 g/mol. Its IUPAC name is 7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine.

Molecular Properties

Compound Name7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine
PubChem CID82249628
Molecular FormulaC13H15Cl2N3
Molecular Weight284.19 g/mol
Exact Mass283.06
IUPAC Name7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine
SMILESCNCc1cc(N(C)C)c2ccc(Cl)c(Cl)c2n1
InChIInChI=1S/C13H15Cl2N3/c1-16-7-8-6-11(18(2)3)9-4-5-10(14)12(15)13(9)17-8/h4-6,16H,7H2,1-3H3
InChIKeyWYKWNJGDXYOIDY-UHFFFAOYSA-N
XLogP3.33
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.19
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-7,8-dichloro-N,N-dimethylquinolin-4-amine
CID 82247413
N,N,8-trimethyl-2-(methylaminomethyl)quinolin-4-amine
CID 82242744
8-fluoro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine
CID 82243094
8-methoxy-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine
CID 82244171
7,8-dichloro-N,N,2-trimethyl-3-(methylaminomethyl)quinolin-4-amine
CID 82251998
5,8-dichloro-N,N-dimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine
CID 82251986
1-(2-tert-butyl-7,8-dichloroquinolin-4-yl)-N-methylmethanamine
CID 82449353
5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine
CID 82248707
7-chloro-8-methyl-2-(methylaminomethyl)quinoline-4-carboxylic acid
CID 84639663
7,8-dichloro-2-(methoxymethyl)-N-methylquinolin-4-amine
CID 62320254
N,N-dimethyl-2-(methylaminomethyl)-6-(trifluoromethoxy)quinolin-4-amine
CID 82252178
7,8-dichloro-2-methylquinoline-4-carbaldehyde
CID 82449304

Frequently Asked Questions

What is the IUPAC name of 7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine?
The IUPAC name of 7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine (CID 82249628) is 7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine.
What is the SMILES notation for 7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine?
The canonical SMILES for 7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine is CNCc1cc(N(C)C)c2ccc(Cl)c(Cl)c2n1.
What is the InChIKey of 7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine?
The InChIKey is WYKWNJGDXYOIDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl2N3/c1-16-7-8-6-11(18(2)3)9-4-5-10(14)12(15)13(9)17-8/h4-6,16H,7H2,1-3H3.
What are the key properties of 7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine?
7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine has a molecular weight of 284.19 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine is sourced from PubChem (CID 82249628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).