5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine

C19H21FN4O — CID 144834039

IUPAC5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine
SMILESCN(C)c1ccc(-c2ccc3cc(OCC(N)CF)ccc3n2)cn1
InChIInChI=1S/C19H21FN4O/c1-24(2)19-8-4-14(11-22-19)18-6-3-13-9-16(5-7-17(13)23-18)25-12-15(21)10-20/h3-9,11,15H,10,12,21H2,1-2H3
InChIKeyMHFVZGTYSDPLJA-UHFFFAOYSA-N
MW340.40 g/mol
LogP3.04
Rot. Bonds6

About 5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine

5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine (PubChem CID 144834039) has the molecular formula C19H21FN4O and a molecular weight of 340.40 g/mol. Its IUPAC name is 5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine
PubChem CID144834039
Molecular FormulaC19H21FN4O
Molecular Weight340.40 g/mol
Exact Mass340.17
IUPAC Name5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine
SMILESCN(C)c1ccc(-c2ccc3cc(OCC(N)CF)ccc3n2)cn1
InChIInChI=1S/C19H21FN4O/c1-24(2)19-8-4-14(11-22-19)18-6-3-13-9-16(5-7-17(13)23-18)25-12-15(21)10-20/h3-9,11,15H,10,12,21H2,1-2H3
InChIKeyMHFVZGTYSDPLJA-UHFFFAOYSA-N
XLogP3.04
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-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

amino-[5-[6-[(2R)-2-hydroxybutoxy]quinolin-2-yl]-2-pyridinyl]cyanamide
CID 146365210
N,N-dimethyl-5-[6-[2-(oxan-2-yloxy)butoxy]quinolin-2-yl]pyridin-2-amine;5-[6-[2-(oxan-2-yloxy)butoxy]quinolin-2-yl]pyridin-2-amine
CID 160797301
1-[2-[4-(dimethylamino)phenyl]quinolin-6-yl]oxy-3-(18F)fluoropropan-2-ol;1-(18F)fluoro-3-[2-[4-(methylamino)phenyl]quinolin-6-yl]oxypropan-2-ol;1-(18F)fluoro-3-[2-[6-(methylamino)-3-pyridinyl]quinolin-6-yl]oxypropan-2-ol
CID 158020962
4-(6-ethoxyquinolin-2-yl)-N,N-dimethylaniline
CID 125465220
(2S)-1-[[2-[6-(dimethylamino)-3-pyridinyl]-1,3-benzoxazol-5-yl]oxy]-3-fluoropropan-2-ol
CID 122413455
4-[6-[2-[2-[2-[2-[2-(2-(18F)fluoroethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]quinolin-2-yl](18F)aniline
CID 73442994
(2R)-3-[2-[4-(dimethylamino)phenyl]quinolin-6-yl]oxy-2-nitrosopropan-1-ol
CID 122518377
1-[2-[4-(dimethylamino)phenyl]quinolin-6-yl]oxypentan-2-ol
CID 170244403
5-[5-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]-1,3-benzoxazol-2-yl]-N,N-dimethylpyridin-2-amine
CID 71453771
6-[6-(dimethylamino)-3-pyridinyl]-N-methylpyrimidin-4-amine
CID 114273206
3-[2-[4-(methylamino)phenyl]quinolin-6-yl]oxypropane-1,2-diol
CID 118642420
(2R)-1-[2-[6-(methylamino)-3-pyridinyl]quinolin-6-yl]oxy-6-propoxyhexan-2-ol
CID 157199901

Frequently Asked Questions

What is the IUPAC name of 5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine?
The IUPAC name of 5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine (CID 144834039) is 5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine is CN(C)c1ccc(-c2ccc3cc(OCC(N)CF)ccc3n2)cn1.
What is the InChIKey of 5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine?
The InChIKey is MHFVZGTYSDPLJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN4O/c1-24(2)19-8-4-14(11-22-19)18-6-3-13-9-16(5-7-17(13)23-18)25-12-15(21)10-20/h3-9,11,15H,10,12,21H2,1-2H3.
What are the key properties of 5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine?
5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine has a molecular weight of 340.40 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(2-amino-3-fluoropropoxy)quinolin-2-yl]-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 144834039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).