7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine

C15H19ClN2O — CID 104722052

IUPAC7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine
SMILESCCCNc1cc(COC)nc2cc(Cl)c(C)cc12
InChIInChI=1S/C15H19ClN2O/c1-4-5-17-14-7-11(9-19-3)18-15-8-13(16)10(2)6-12(14)15/h6-8H,4-5,9H2,1-3H3,(H,17,18)
InChIKeyFMSDERNROPFUKT-UHFFFAOYSA-N
MW278.78 g/mol
LogP4.16
Rot. Bonds5

About 7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine

7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine (PubChem CID 104722052) has the molecular formula C15H19ClN2O and a molecular weight of 278.78 g/mol. Its IUPAC name is 7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine.

Molecular Properties

Compound Name7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine
PubChem CID104722052
Molecular FormulaC15H19ClN2O
Molecular Weight278.78 g/mol
Exact Mass278.12
IUPAC Name7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine
SMILESCCCNc1cc(COC)nc2cc(Cl)c(C)cc12
InChIInChI=1S/C15H19ClN2O/c1-4-5-17-14-7-11(9-19-3)18-15-8-13(16)10(2)6-12(14)15/h6-8H,4-5,9H2,1-3H3,(H,17,18)
InChIKeyFMSDERNROPFUKT-UHFFFAOYSA-N
XLogP4.16
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.78
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6,8-dichloro-2-(methoxymethyl)-N-propylquinolin-4-amine
CID 55062733
6-ethyl-2-(methoxymethyl)-N-propylquinolin-4-amine
CID 55062783
6-chloro-N-ethyl-7-fluoro-2-(methoxymethyl)quinolin-4-amine
CID 113363427
2-(methoxymethyl)-7,8-dimethyl-N-propylquinolin-4-amine
CID 55062350
8-chloro-5-fluoro-2-(methoxymethyl)-N-propylquinolin-4-amine
CID 107531260
7-bromo-2-(methoxymethyl)-8-methyl-N-propylquinolin-4-amine
CID 107628600
6-bromo-8-fluoro-2-(methoxymethyl)-N-propylquinolin-4-amine
CID 62319897
6-chloro-7-methoxy-2-methyl-N-propylquinolin-4-amine
CID 107623108
2-(3-chloro-4-methylphenyl)-6-(methoxymethyl)-N-propylpyrimidin-4-amine
CID 106818371
7-chloro-3-ethyl-2,6-dimethyl-N-propylquinolin-4-amine
CID 104722062
7-chloro-N-ethyl-8-fluoro-2-(methoxymethyl)quinolin-4-amine
CID 55062636
7,8-dichloro-N-ethyl-2-(methoxymethyl)quinolin-4-amine
CID 62320255

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine?
The IUPAC name of 7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine (CID 104722052) is 7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine.
What is the SMILES notation for 7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine?
The canonical SMILES for 7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine is CCCNc1cc(COC)nc2cc(Cl)c(C)cc12.
What is the InChIKey of 7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine?
The InChIKey is FMSDERNROPFUKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O/c1-4-5-17-14-7-11(9-19-3)18-15-8-13(16)10(2)6-12(14)15/h6-8H,4-5,9H2,1-3H3,(H,17,18).
What are the key properties of 7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine?
7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine has a molecular weight of 278.78 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine is sourced from PubChem (CID 104722052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).