N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine

C15H19FN2 — CID 103996204

IUPACN-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine
SMILESCCCc1cc(NCC)c2cc(C)c(F)cc2n1
InChIInChI=1S/C15H19FN2/c1-4-6-11-8-14(17-5-2)12-7-10(3)13(16)9-15(12)18-11/h7-9H,4-6H2,1-3H3,(H,17,18)
InChIKeyWFRCPIZEHMCKAQ-UHFFFAOYSA-N
MW246.33 g/mol
LogP4.07
Rot. Bonds4

About N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine

N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine (PubChem CID 103996204) has the molecular formula C15H19FN2 and a molecular weight of 246.33 g/mol. Its IUPAC name is N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine.

Molecular Properties

Compound NameN-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine
PubChem CID103996204
Molecular FormulaC15H19FN2
Molecular Weight246.33 g/mol
Exact Mass246.15
IUPAC NameN-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine
SMILESCCCc1cc(NCC)c2cc(C)c(F)cc2n1
InChIInChI=1S/C15H19FN2/c1-4-6-11-8-14(17-5-2)12-7-10(3)13(16)9-15(12)18-11/h7-9H,4-6H2,1-3H3,(H,17,18)
InChIKeyWFRCPIZEHMCKAQ-UHFFFAOYSA-N
XLogP4.07
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.33
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine?
The IUPAC name of N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine (CID 103996204) is N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine.
What is the SMILES notation for N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine?
The canonical SMILES for N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine is CCCc1cc(NCC)c2cc(C)c(F)cc2n1.
What is the InChIKey of N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine?
The InChIKey is WFRCPIZEHMCKAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2/c1-4-6-11-8-14(17-5-2)12-7-10(3)13(16)9-15(12)18-11/h7-9H,4-6H2,1-3H3,(H,17,18).
What are the key properties of N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine?
N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine has a molecular weight of 246.33 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine is sourced from PubChem (CID 103996204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).