8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine

C14H14ClF3N2 — CID 63744425

IUPAC8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine
SMILESCCCNc1c(C)c(C(F)(F)F)nc2c(Cl)cccc12
InChIInChI=1S/C14H14ClF3N2/c1-3-7-19-11-8(2)13(14(16,17)18)20-12-9(11)5-4-6-10(12)15/h4-6H,3,7H2,1-2H3,(H,19,20)
InChIKeyPHSYIDCJHVVHKA-UHFFFAOYSA-N
MW302.73 g/mol
LogP5.04
Rot. Bonds3

About 8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine

8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine (PubChem CID 63744425) has the molecular formula C14H14ClF3N2 and a molecular weight of 302.73 g/mol. Its IUPAC name is 8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine.

Molecular Properties

Compound Name8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine
PubChem CID63744425
Molecular FormulaC14H14ClF3N2
Molecular Weight302.73 g/mol
Exact Mass302.08
IUPAC Name8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine
SMILESCCCNc1c(C)c(C(F)(F)F)nc2c(Cl)cccc12
InChIInChI=1S/C14H14ClF3N2/c1-3-7-19-11-8(2)13(14(16,17)18)20-12-9(11)5-4-6-10(12)15/h4-6H,3,7H2,1-2H3,(H,19,20)
InChIKeyPHSYIDCJHVVHKA-UHFFFAOYSA-N
XLogP5.04
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.73
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-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

7-fluoro-3,8-dimethyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine
CID 63744759
8-chloro-2-ethyl-3-methyl-N-propylquinolin-4-amine
CID 63560531
5-chloro-3,8-dimethyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine
CID 63743734
N-ethyl-3,8-dimethyl-2-(trifluoromethyl)quinolin-4-amine
CID 55231276
8-fluoro-3,6-dimethyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine
CID 63743224
6,7-difluoro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine
CID 63744755
8-chloro-2-methyl-3-propan-2-yl-N-propylquinolin-4-amine
CID 63480623
8-chloro-2-propan-2-yl-N-propylquinolin-4-amine
CID 63480780
[3,7,8-trimethyl-2-(trifluoromethyl)quinolin-4-yl]hydrazine
CID 55229164
6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine
CID 63562406
8-chloro-5-iodo-2,3-dimethyl-N-propylquinolin-4-amine
CID 114260950
8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine
CID 62890710

Frequently Asked Questions

What is the IUPAC name of 8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine?
The IUPAC name of 8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine (CID 63744425) is 8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine.
What is the SMILES notation for 8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine?
The canonical SMILES for 8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine is CCCNc1c(C)c(C(F)(F)F)nc2c(Cl)cccc12.
What is the InChIKey of 8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine?
The InChIKey is PHSYIDCJHVVHKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClF3N2/c1-3-7-19-11-8(2)13(14(16,17)18)20-12-9(11)5-4-6-10(12)15/h4-6H,3,7H2,1-2H3,(H,19,20).
What are the key properties of 8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine?
8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine has a molecular weight of 302.73 g/mol, XLogP of 5.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-3-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine is sourced from PubChem (CID 63744425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).