4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine

C14H15ClF2N2 — CID 63180130

IUPAC4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine
SMILESCCN(CC)c1ccc2nc(C(F)F)cc(Cl)c2c1
InChIInChI=1S/C14H15ClF2N2/c1-3-19(4-2)9-5-6-12-10(7-9)11(15)8-13(18-12)14(16)17/h5-8,14H,3-4H2,1-2H3
InChIKeyPARLNDAQSHZWEL-UHFFFAOYSA-N
MW284.74 g/mol
LogP4.67
Rot. Bonds4

About 4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine

4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine (PubChem CID 63180130) has the molecular formula C14H15ClF2N2 and a molecular weight of 284.74 g/mol. Its IUPAC name is 4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine.

Molecular Properties

Compound Name4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine
PubChem CID63180130
Molecular FormulaC14H15ClF2N2
Molecular Weight284.74 g/mol
Exact Mass284.09
IUPAC Name4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine
SMILESCCN(CC)c1ccc2nc(C(F)F)cc(Cl)c2c1
InChIInChI=1S/C14H15ClF2N2/c1-3-19(4-2)9-5-6-12-10(7-9)11(15)8-13(18-12)14(16)17/h5-8,14H,3-4H2,1-2H3
InChIKeyPARLNDAQSHZWEL-UHFFFAOYSA-N
XLogP4.67
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.74
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-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

4-chloro-2-(difluoromethyl)-6-ethylquinoline
CID 62892996
6-N,6-N-diethylquinazoline-2,4,6-triamine
CID 44531790
6-N,6-N,2-triethylquinoline-4,6-diamine
CID 63180601
N,N,2-triethyl-4-hydrazinylquinolin-6-amine
CID 63180817
4-chloro-6-(diethylamino)quinoline-3-carbonitrile
CID 63180357
4-chloro-2-(difluoromethyl)-5,8-difluoroquinoline
CID 62890910
6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine
CID 63180558
2-N,2-N-diethyl-8-N,8-N-dimethylphenazine-2,8-diamine
CID 46832728
N,N-diethyl-2-methylquinolin-6-amine
CID 23464022
4-(difluoromethyl)-N,N-diethylaniline
CID 154791327
2-tert-butyl-6-N,6-N-diethyl-4-N-methylquinoline-4,6-diamine
CID 63483860
6-N,6-N-diethyl-2-methyl-4-N-propylquinoline-4,6-diamine
CID 63483498

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine?
The IUPAC name of 4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine (CID 63180130) is 4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine.
What is the SMILES notation for 4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine?
The canonical SMILES for 4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine is CCN(CC)c1ccc2nc(C(F)F)cc(Cl)c2c1.
What is the InChIKey of 4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine?
The InChIKey is PARLNDAQSHZWEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClF2N2/c1-3-19(4-2)9-5-6-12-10(7-9)11(15)8-13(18-12)14(16)17/h5-8,14H,3-4H2,1-2H3.
What are the key properties of 4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine?
4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine has a molecular weight of 284.74 g/mol, XLogP of 4.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(difluoromethyl)-N,N-diethylquinolin-6-amine is sourced from PubChem (CID 63180130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).