7-chloro-N-ethyl-N-methylquinolin-4-amine

C12H13ClN2 — CID 123939218

IUPAC7-chloro-N-ethyl-N-methylquinolin-4-amine
SMILESCCN(C)c1ccnc2cc(Cl)ccc12
InChIInChI=1S/C12H13ClN2/c1-3-15(2)12-6-7-14-11-8-9(13)4-5-10(11)12/h4-8H,3H2,1-2H3
InChIKeyWQHZBVFPMXYIKU-UHFFFAOYSA-N
MW220.70 g/mol
LogP3.34
Rot. Bonds2

About 7-chloro-N-ethyl-N-methylquinolin-4-amine

7-chloro-N-ethyl-N-methylquinolin-4-amine (PubChem CID 123939218) has the molecular formula C12H13ClN2 and a molecular weight of 220.70 g/mol. Its IUPAC name is 7-chloro-N-ethyl-N-methylquinolin-4-amine.

Molecular Properties

Compound Name7-chloro-N-ethyl-N-methylquinolin-4-amine
PubChem CID123939218
Molecular FormulaC12H13ClN2
Molecular Weight220.70 g/mol
Exact Mass220.08
IUPAC Name7-chloro-N-ethyl-N-methylquinolin-4-amine
SMILESCCN(C)c1ccnc2cc(Cl)ccc12
InChIInChI=1S/C12H13ClN2/c1-3-15(2)12-6-7-14-11-8-9(13)4-5-10(11)12/h4-8H,3H2,1-2H3
InChIKeyWQHZBVFPMXYIKU-UHFFFAOYSA-N
XLogP3.34
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.70
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(7-chloroquinolin-4-yl)-methylamino]ethanol
CID 60631611
1-[(7-chloroquinolin-4-yl)-methylamino]propan-2-ol
CID 55061126
N'-(7-chloroquinolin-4-yl)-N'-methyl-N-propylethane-1,2-diamine
CID 55090859
5-[(7-chloroquinolin-4-yl)-methylamino]pentan-1-ol
CID 107203509
7-chloro-N-methyl-N-(piperidin-4-ylmethyl)quinolin-4-amine
CID 79719664
7-chloro-N-methyl-N-pentan-2-ylquinolin-4-amine
CID 175101237
7-chloro-N-[2-(2-chloroethoxy)ethyl]-N-methylquinolin-4-amine
CID 114242626
7-chloro-N-methyl-N-(piperidin-2-ylmethyl)quinolin-4-amine
CID 106642173
7-chloro-N-methyl-N-(piperidin-3-ylmethyl)quinolin-4-amine
CID 106642854
4-N-(7-chloroquinolin-4-yl)-1-N,4-N-diethylcyclohexane-1,4-diamine
CID 66921322
3-[(7-chloroquinolin-4-yl)-methylamino]-2-methylpropanimidamide
CID 54990454
N-(7-chloroquinolin-4-yl)-N-[2-(diethylamino)ethyl]propanamide
CID 20753586

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-ethyl-N-methylquinolin-4-amine?
The IUPAC name of 7-chloro-N-ethyl-N-methylquinolin-4-amine (CID 123939218) is 7-chloro-N-ethyl-N-methylquinolin-4-amine.
What is the SMILES notation for 7-chloro-N-ethyl-N-methylquinolin-4-amine?
The canonical SMILES for 7-chloro-N-ethyl-N-methylquinolin-4-amine is CCN(C)c1ccnc2cc(Cl)ccc12.
What is the InChIKey of 7-chloro-N-ethyl-N-methylquinolin-4-amine?
The InChIKey is WQHZBVFPMXYIKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN2/c1-3-15(2)12-6-7-14-11-8-9(13)4-5-10(11)12/h4-8H,3H2,1-2H3.
What are the key properties of 7-chloro-N-ethyl-N-methylquinolin-4-amine?
7-chloro-N-ethyl-N-methylquinolin-4-amine has a molecular weight of 220.70 g/mol, XLogP of 3.34, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-ethyl-N-methylquinolin-4-amine is sourced from PubChem (CID 123939218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).