5,6,7-trifluoro-3-methylquinolin-2-amine

C10H7F3N2 — CID 63232439

IUPAC5,6,7-trifluoro-3-methylquinolin-2-amine
SMILESCc1cc2c(F)c(F)c(F)cc2nc1N
InChIInChI=1S/C10H7F3N2/c1-4-2-5-7(15-10(4)14)3-6(11)9(13)8(5)12/h2-3H,1H3,(H2,14,15)
InChIKeyUCNPVQCCSZTCNR-UHFFFAOYSA-N
MW212.17 g/mol
LogP2.54
Rot. Bonds

About 5,6,7-trifluoro-3-methylquinolin-2-amine

5,6,7-trifluoro-3-methylquinolin-2-amine (PubChem CID 63232439) has the molecular formula C10H7F3N2 and a molecular weight of 212.17 g/mol. Its IUPAC name is 5,6,7-trifluoro-3-methylquinolin-2-amine.

Molecular Properties

Compound Name5,6,7-trifluoro-3-methylquinolin-2-amine
PubChem CID63232439
Molecular FormulaC10H7F3N2
Molecular Weight212.17 g/mol
Exact Mass212.06
IUPAC Name5,6,7-trifluoro-3-methylquinolin-2-amine
SMILESCc1cc2c(F)c(F)c(F)cc2nc1N
InChIInChI=1S/C10H7F3N2/c1-4-2-5-7(15-10(4)14)3-6(11)9(13)8(5)12/h2-3H,1H3,(H2,14,15)
InChIKeyUCNPVQCCSZTCNR-UHFFFAOYSA-N
XLogP2.54
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.17
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Analyze 5,6,7-trifluoro-3-methylquinolin-2-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

5,6,7-trifluoro-3-propylquinolin-2-amine
CID 63232437
5,6,7-trifluoro-3-methyl-N-propylquinolin-2-amine
CID 63232523
3,5,7-trimethylquinolin-2-amine;hydrochloride
CID 43865999
5-fluoro-3,8-dimethylquinolin-2-amine
CID 63231677
7,8-difluoro-3-methylquinolin-2-amine
CID 63232819
5,7-dimethoxy-3-methylquinolin-2-amine
CID 63232255
2-chloro-5,6,7-trifluoro-3-propan-2-ylquinoline
CID 63231799
3-ethyl-5,6,7-trifluoro-N-methylquinolin-2-amine
CID 63232484
methyl 2-amino-3,5-dimethylquinoline-6-carboxylate
CID 156830913
3-methyl-1,5-naphthyridin-2-amine
CID 30484461
4,6,7-trimethylquinazolin-2-amine
CID 919132
3-ethyl-7-fluoro-6-methylquinolin-2-amine
CID 112674484

Frequently Asked Questions

What is the IUPAC name of 5,6,7-trifluoro-3-methylquinolin-2-amine?
The IUPAC name of 5,6,7-trifluoro-3-methylquinolin-2-amine (CID 63232439) is 5,6,7-trifluoro-3-methylquinolin-2-amine.
What is the SMILES notation for 5,6,7-trifluoro-3-methylquinolin-2-amine?
The canonical SMILES for 5,6,7-trifluoro-3-methylquinolin-2-amine is Cc1cc2c(F)c(F)c(F)cc2nc1N.
What is the InChIKey of 5,6,7-trifluoro-3-methylquinolin-2-amine?
The InChIKey is UCNPVQCCSZTCNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F3N2/c1-4-2-5-7(15-10(4)14)3-6(11)9(13)8(5)12/h2-3H,1H3,(H2,14,15).
What are the key properties of 5,6,7-trifluoro-3-methylquinolin-2-amine?
5,6,7-trifluoro-3-methylquinolin-2-amine has a molecular weight of 212.17 g/mol, XLogP of 2.54, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7-trifluoro-3-methylquinolin-2-amine is sourced from PubChem (CID 63232439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).