7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine

C13H15FN2 — CID 62196606

IUPAC7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine
SMILESCc1c(F)ccc2c(N)cc(C(C)C)nc12
InChIInChI=1S/C13H15FN2/c1-7(2)12-6-11(15)9-4-5-10(14)8(3)13(9)16-12/h4-7H,1-3H3,(H2,15,16)
InChIKeyRWVWVEAUEJVQMY-UHFFFAOYSA-N
MW218.27 g/mol
LogP3.39
Rot. Bonds1

About 7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine

7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine (PubChem CID 62196606) has the molecular formula C13H15FN2 and a molecular weight of 218.27 g/mol. Its IUPAC name is 7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine.

Molecular Properties

Compound Name7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine
PubChem CID62196606
Molecular FormulaC13H15FN2
Molecular Weight218.27 g/mol
Exact Mass218.12
IUPAC Name7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine
SMILESCc1c(F)ccc2c(N)cc(C(C)C)nc12
InChIInChI=1S/C13H15FN2/c1-7(2)12-6-11(15)9-4-5-10(14)8(3)13(9)16-12/h4-7H,1-3H3,(H2,15,16)
InChIKeyRWVWVEAUEJVQMY-UHFFFAOYSA-N
XLogP3.39
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.27
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine?
The IUPAC name of 7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine (CID 62196606) is 7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine.
What is the SMILES notation for 7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine?
The canonical SMILES for 7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine is Cc1c(F)ccc2c(N)cc(C(C)C)nc12.
What is the InChIKey of 7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine?
The InChIKey is RWVWVEAUEJVQMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN2/c1-7(2)12-6-11(15)9-4-5-10(14)8(3)13(9)16-12/h4-7H,1-3H3,(H2,15,16).
What are the key properties of 7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine?
7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine has a molecular weight of 218.27 g/mol, XLogP of 3.39, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-8-methyl-2-propan-2-ylquinolin-4-amine is sourced from PubChem (CID 62196606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).