2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine

C15H17FN2 — CID 55190697

IUPAC2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine
SMILESCCNc1cc(C2CC2)nc2c(C)cc(F)cc12
InChIInChI=1S/C15H17FN2/c1-3-17-14-8-13(10-4-5-10)18-15-9(2)6-11(16)7-12(14)15/h6-8,10H,3-5H2,1-2H3,(H,17,18)
InChIKeyWJLWHYMARPXMSW-UHFFFAOYSA-N
MW244.31 g/mol
LogP3.99
Rot. Bonds3

About 2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine

2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine (PubChem CID 55190697) has the molecular formula C15H17FN2 and a molecular weight of 244.31 g/mol. Its IUPAC name is 2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine
PubChem CID55190697
Molecular FormulaC15H17FN2
Molecular Weight244.31 g/mol
Exact Mass244.14
IUPAC Name2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine
SMILESCCNc1cc(C2CC2)nc2c(C)cc(F)cc12
InChIInChI=1S/C15H17FN2/c1-3-17-14-8-13(10-4-5-10)18-15-9(2)6-11(16)7-12(14)15/h6-8,10H,3-5H2,1-2H3,(H,17,18)
InChIKeyWJLWHYMARPXMSW-UHFFFAOYSA-N
XLogP3.99
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.31
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine?
The IUPAC name of 2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine (CID 55190697) is 2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine.
What is the SMILES notation for 2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine?
The canonical SMILES for 2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine is CCNc1cc(C2CC2)nc2c(C)cc(F)cc12.
What is the InChIKey of 2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine?
The InChIKey is WJLWHYMARPXMSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2/c1-3-17-14-8-13(10-4-5-10)18-15-9(2)6-11(16)7-12(14)15/h6-8,10H,3-5H2,1-2H3,(H,17,18).
What are the key properties of 2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine?
2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine has a molecular weight of 244.31 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-ethyl-6-fluoro-8-methylquinolin-4-amine is sourced from PubChem (CID 55190697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).