2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine

C14H15FN2 — CID 55190878

IUPAC2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine
SMILESCCNc1cc(C2CC2)nc2c(F)cccc12
InChIInChI=1S/C14H15FN2/c1-2-16-13-8-12(9-6-7-9)17-14-10(13)4-3-5-11(14)15/h3-5,8-9H,2,6-7H2,1H3,(H,16,17)
InChIKeyLXPJATGQFCMMRL-UHFFFAOYSA-N
MW230.29 g/mol
LogP3.68
Rot. Bonds3

About 2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine

2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine (PubChem CID 55190878) has the molecular formula C14H15FN2 and a molecular weight of 230.29 g/mol. Its IUPAC name is 2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine
PubChem CID55190878
Molecular FormulaC14H15FN2
Molecular Weight230.29 g/mol
Exact Mass230.12
IUPAC Name2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine
SMILESCCNc1cc(C2CC2)nc2c(F)cccc12
InChIInChI=1S/C14H15FN2/c1-2-16-13-8-12(9-6-7-9)17-14-10(13)4-3-5-11(14)15/h3-5,8-9H,2,6-7H2,1H3,(H,16,17)
InChIKeyLXPJATGQFCMMRL-UHFFFAOYSA-N
XLogP3.68
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 53.68
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-8-fluoroquinolin-4-amine?
The IUPAC name of 2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine (CID 55190878) is 2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine.
What is the SMILES notation for 2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine?
The canonical SMILES for 2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine is CCNc1cc(C2CC2)nc2c(F)cccc12.
What is the InChIKey of 2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine?
The InChIKey is LXPJATGQFCMMRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2/c1-2-16-13-8-12(9-6-7-9)17-14-10(13)4-3-5-11(14)15/h3-5,8-9H,2,6-7H2,1H3,(H,16,17).
What are the key properties of 2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine?
2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine has a molecular weight of 230.29 g/mol, XLogP of 3.68, 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-8-fluoroquinolin-4-amine is sourced from PubChem (CID 55190878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).