2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine

C15H20ClN3O — CID 82251230

IUPAC2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine
SMILESCOc1cc(Cl)c(C)c2c(N(C)C)cc(CCN)nc12
InChIInChI=1S/C15H20ClN3O/c1-9-11(16)8-13(20-4)15-14(9)12(19(2)3)7-10(18-15)5-6-17/h7-8H,5-6,17H2,1-4H3
InChIKeyHLSWYKSKVNBYRB-UHFFFAOYSA-N
MW293.80 g/mol
LogP2.77
Rot. Bonds4

About 2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine

2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine (PubChem CID 82251230) has the molecular formula C15H20ClN3O and a molecular weight of 293.80 g/mol. Its IUPAC name is 2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine.

Molecular Properties

Compound Name2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine
PubChem CID82251230
Molecular FormulaC15H20ClN3O
Molecular Weight293.80 g/mol
Exact Mass293.13
IUPAC Name2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine
SMILESCOc1cc(Cl)c(C)c2c(N(C)C)cc(CCN)nc12
InChIInChI=1S/C15H20ClN3O/c1-9-11(16)8-13(20-4)15-14(9)12(19(2)3)7-10(18-15)5-6-17/h7-8H,5-6,17H2,1-4H3
InChIKeyHLSWYKSKVNBYRB-UHFFFAOYSA-N
XLogP2.77
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.80
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(aminomethyl)-8-methoxy-N,N,2-trimethylquinolin-4-amine
CID 82573714
2-(5-chloro-2,3-dimethoxy-6-methylphenyl)ethanamine
CID 84693141
2-(4-chloro-8-methoxy-2-methylquinolin-5-yl)ethanamine
CID 82575640
2-(5-chloro-4,8-dimethylquinolin-2-yl)ethanamine
CID 82575558
2-(2-aminoethyl)-8-fluoro-N,N-dimethylquinolin-4-amine
CID 82243092
5,8-dichloro-N,N-dimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine
CID 82251986
5-(4-aminobutyl)-6-methoxy-N,N,2-trimethylquinolin-4-amine
CID 82577852
2-[6-(3-chloro-4-methoxyphenyl)pyridazin-3-yl]ethanamine
CID 82303495
3-(5-chloro-2,3-dimethoxy-6-methylphenyl)propan-1-amine
CID 117361452
4-(3-chloro-5-methoxy-4-methylphenyl)butan-1-amine
CID 117328078
(2-chloro-4-methoxy-5-methylphenyl)methanamine
CID 57458151
2-(aminomethyl)-7,8-dichloro-N,N-dimethylquinolin-4-amine
CID 82247413

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine?
The IUPAC name of 2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine (CID 82251230) is 2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine.
What is the SMILES notation for 2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine?
The canonical SMILES for 2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine is COc1cc(Cl)c(C)c2c(N(C)C)cc(CCN)nc12.
What is the InChIKey of 2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine?
The InChIKey is HLSWYKSKVNBYRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O/c1-9-11(16)8-13(20-4)15-14(9)12(19(2)3)7-10(18-15)5-6-17/h7-8H,5-6,17H2,1-4H3.
What are the key properties of 2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine?
2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine has a molecular weight of 293.80 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine is sourced from PubChem (CID 82251230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).