8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine

C12H12ClFN2 — CID 62203429

IUPAC8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine
SMILESCNc1c(C)c(C)nc2c(Cl)cc(F)cc12
InChIInChI=1S/C12H12ClFN2/c1-6-7(2)16-12-9(11(6)15-3)4-8(14)5-10(12)13/h4-5H,1-3H3,(H,15,16)
InChIKeyUUAVUCQRANYDMB-UHFFFAOYSA-N
MW238.69 g/mol
LogP3.69
Rot. Bonds1

About 8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine

8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine (PubChem CID 62203429) has the molecular formula C12H12ClFN2 and a molecular weight of 238.69 g/mol. Its IUPAC name is 8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine.

Molecular Properties

Compound Name8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine
PubChem CID62203429
Molecular FormulaC12H12ClFN2
Molecular Weight238.69 g/mol
Exact Mass238.07
IUPAC Name8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine
SMILESCNc1c(C)c(C)nc2c(Cl)cc(F)cc12
InChIInChI=1S/C12H12ClFN2/c1-6-7(2)16-12-9(11(6)15-3)4-8(14)5-10(12)13/h4-5H,1-3H3,(H,15,16)
InChIKeyUUAVUCQRANYDMB-UHFFFAOYSA-N
XLogP3.69
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.69
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-chloro-6-fluoro-N,2,3-trimethylquinolin-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

Related Compounds

8-chloro-6-fluoro-2,3-dimethylquinolin-4-amine
CID 62203582
6-chloro-N,2,3,8-tetramethylquinolin-4-amine
CID 62195933
8-chloro-N,3-diethyl-6-fluoro-2-methylquinolin-4-amine
CID 55197104
8-chloro-6-fluoro-N-methylquinolin-4-amine
CID 62192590
5-chloro-N-ethyl-7-fluoro-2,3-dimethylquinolin-4-amine
CID 107370549
(8-chloro-6-fluoro-2-propan-2-ylquinolin-4-yl)hydrazine
CID 62250595
4,6,8-trichloro-2,3-dimethylquinoline
CID 63409062
6-chloro-2-ethyl-7-fluoro-N,3-dimethylquinolin-4-amine
CID 113363430
8-chloro-2-ethyl-6-fluoro-3H-quinazolin-4-one
CID 136743464
7-chloro-N,3,6-trimethyl-2-(trifluoromethyl)quinolin-4-amine
CID 104722067
8-chloro-N,2-diethyl-6-fluoroquinolin-4-amine
CID 63479104
3-tert-butyl-8-chloro-6-fluoro-N-methylquinolin-2-amine
CID 63382241

Frequently Asked Questions

What is the IUPAC name of 8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine?
The IUPAC name of 8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine (CID 62203429) is 8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine.
What is the SMILES notation for 8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine?
The canonical SMILES for 8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine is CNc1c(C)c(C)nc2c(Cl)cc(F)cc12.
What is the InChIKey of 8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine?
The InChIKey is UUAVUCQRANYDMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClFN2/c1-6-7(2)16-12-9(11(6)15-3)4-8(14)5-10(12)13/h4-5H,1-3H3,(H,15,16).
What are the key properties of 8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine?
8-chloro-6-fluoro-N,2,3-trimethylquinolin-4-amine has a molecular weight of 238.69 g/mol, XLogP of 3.69, 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,2,3-trimethylquinolin-4-amine is sourced from PubChem (CID 62203429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).