5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine

C15H20ClN3 — CID 82248707

IUPAC5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine
SMILESCNCCc1cc(N(C)C)c2c(Cl)ccc(C)c2n1
InChIInChI=1S/C15H20ClN3/c1-10-5-6-12(16)14-13(19(3)4)9-11(7-8-17-2)18-15(10)14/h5-6,9,17H,7-8H2,1-4H3
InChIKeyDAWBKXZBLCEATO-UHFFFAOYSA-N
MW277.80 g/mol
LogP3.02
Rot. Bonds4

About 5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine

5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine (PubChem CID 82248707) has the molecular formula C15H20ClN3 and a molecular weight of 277.80 g/mol. Its IUPAC name is 5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine.

Molecular Properties

Compound Name5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine
PubChem CID82248707
Molecular FormulaC15H20ClN3
Molecular Weight277.80 g/mol
Exact Mass277.13
IUPAC Name5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine
SMILESCNCCc1cc(N(C)C)c2c(Cl)ccc(C)c2n1
InChIInChI=1S/C15H20ClN3/c1-10-5-6-12(16)14-13(19(3)4)9-11(7-8-17-2)18-15(10)14/h5-6,9,17H,7-8H2,1-4H3
InChIKeyDAWBKXZBLCEATO-UHFFFAOYSA-N
XLogP3.02
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.80
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5,8-dichloro-N,N-dimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine
CID 82251986
5-chloro-4-(dimethylamino)-8-methylquinoline-2-carbonitrile
CID 82244207
2-(5-chloro-4,8-dimethylquinolin-2-yl)ethanamine
CID 82575558
2-(8-chloro-4-methylquinolin-2-yl)-N-methylethanamine
CID 84627983
3-(5-chloro-4,8-dimethylquinolin-2-yl)propan-1-amine
CID 82576607
2-(5-chloro-3,8-dimethylquinolin-2-yl)-N-methylethanamine
CID 82244742
7,8-dichloro-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine
CID 82249628
N,N,2,5,8-pentamethylquinolin-4-amine
CID 82581214
N,N-dimethyl-2-[2-(methylamino)ethyl]quinolin-6-amine
CID 82242740
N,N,8-trimethyl-2-(methylaminomethyl)quinolin-4-amine
CID 82242744
2-(2-aminoethyl)-6-chloro-8-methoxy-N,N,5-trimethylquinolin-4-amine
CID 82251230
2-(7-chloro-3,8-dimethylquinolin-2-yl)-N-methylethanamine
CID 82244741

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine?
The IUPAC name of 5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine (CID 82248707) is 5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine.
What is the SMILES notation for 5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine?
The canonical SMILES for 5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine is CNCCc1cc(N(C)C)c2c(Cl)ccc(C)c2n1.
What is the InChIKey of 5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine?
The InChIKey is DAWBKXZBLCEATO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3/c1-10-5-6-12(16)14-13(19(3)4)9-11(7-8-17-2)18-15(10)14/h5-6,9,17H,7-8H2,1-4H3.
What are the key properties of 5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine?
5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine has a molecular weight of 277.80 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N,N,8-trimethyl-2-[2-(methylamino)ethyl]quinolin-4-amine is sourced from PubChem (CID 82248707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).