8-chloro-6-fluoro-N-methylquinolin-4-amine

C10H8ClFN2 — CID 62192590

IUPAC8-chloro-6-fluoro-N-methylquinolin-4-amine
SMILESCNc1ccnc2c(Cl)cc(F)cc12
InChIInChI=1S/C10H8ClFN2/c1-13-9-2-3-14-10-7(9)4-6(12)5-8(10)11/h2-5H,1H3,(H,13,14)
InChIKeyRSVRKOVLFXRHPX-UHFFFAOYSA-N
MW210.64 g/mol
LogP3.07
Rot. Bonds1

About 8-chloro-6-fluoro-N-methylquinolin-4-amine

8-chloro-6-fluoro-N-methylquinolin-4-amine (PubChem CID 62192590) has the molecular formula C10H8ClFN2 and a molecular weight of 210.64 g/mol. Its IUPAC name is 8-chloro-6-fluoro-N-methylquinolin-4-amine.

Molecular Properties

Compound Name8-chloro-6-fluoro-N-methylquinolin-4-amine
PubChem CID62192590
Molecular FormulaC10H8ClFN2
Molecular Weight210.64 g/mol
Exact Mass210.04
IUPAC Name8-chloro-6-fluoro-N-methylquinolin-4-amine
SMILESCNc1ccnc2c(Cl)cc(F)cc12
InChIInChI=1S/C10H8ClFN2/c1-13-9-2-3-14-10-7(9)4-6(12)5-8(10)11/h2-5H,1H3,(H,13,14)
InChIKeyRSVRKOVLFXRHPX-UHFFFAOYSA-N
XLogP3.07
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.64
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-6-fluoro-N-methylquinolin-4-amine?
The IUPAC name of 8-chloro-6-fluoro-N-methylquinolin-4-amine (CID 62192590) is 8-chloro-6-fluoro-N-methylquinolin-4-amine.
What is the SMILES notation for 8-chloro-6-fluoro-N-methylquinolin-4-amine?
The canonical SMILES for 8-chloro-6-fluoro-N-methylquinolin-4-amine is CNc1ccnc2c(Cl)cc(F)cc12.
What is the InChIKey of 8-chloro-6-fluoro-N-methylquinolin-4-amine?
The InChIKey is RSVRKOVLFXRHPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClFN2/c1-13-9-2-3-14-10-7(9)4-6(12)5-8(10)11/h2-5H,1H3,(H,13,14).
What are the key properties of 8-chloro-6-fluoro-N-methylquinolin-4-amine?
8-chloro-6-fluoro-N-methylquinolin-4-amine has a molecular weight of 210.64 g/mol, XLogP of 3.07, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-6-fluoro-N-methylquinolin-4-amine is sourced from PubChem (CID 62192590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).