N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine

C15H18F2N2 — CID 103587506

IUPACN-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine
SMILESCCCc1cc2c(F)c(C)cc(F)c2nc1NCC
InChIInChI=1S/C15H18F2N2/c1-4-6-10-8-11-13(17)9(3)7-12(16)14(11)19-15(10)18-5-2/h7-8H,4-6H2,1-3H3,(H,18,19)
InChIKeyRLLNOQWJPKOFEN-UHFFFAOYSA-N
MW264.32 g/mol
LogP4.21
Rot. Bonds4

About N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine

N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine (PubChem CID 103587506) has the molecular formula C15H18F2N2 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine.

Molecular Properties

Compound NameN-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine
PubChem CID103587506
Molecular FormulaC15H18F2N2
Molecular Weight264.32 g/mol
Exact Mass264.14
IUPAC NameN-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine
SMILESCCCc1cc2c(F)c(C)cc(F)c2nc1NCC
InChIInChI=1S/C15H18F2N2/c1-4-6-10-8-11-13(17)9(3)7-12(16)14(11)19-15(10)18-5-2/h7-8H,4-6H2,1-3H3,(H,18,19)
InChIKeyRLLNOQWJPKOFEN-UHFFFAOYSA-N
XLogP4.21
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine?
The IUPAC name of N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine (CID 103587506) is N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine.
What is the SMILES notation for N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine?
The canonical SMILES for N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine is CCCc1cc2c(F)c(C)cc(F)c2nc1NCC.
What is the InChIKey of N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine?
The InChIKey is RLLNOQWJPKOFEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F2N2/c1-4-6-10-8-11-13(17)9(3)7-12(16)14(11)19-15(10)18-5-2/h7-8H,4-6H2,1-3H3,(H,18,19).
What are the key properties of N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine?
N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine has a molecular weight of 264.32 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine is sourced from PubChem (CID 103587506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).