N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine

C19H19F2N3 — CID 15272240

IUPACN-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine
SMILESCN(C)CCNc1cc(-c2ccccc2F)nc2ccc(F)cc12
InChIInChI=1S/C19H19F2N3/c1-24(2)10-9-22-18-12-19(14-5-3-4-6-16(14)21)23-17-8-7-13(20)11-15(17)18/h3-8,11-12H,9-10H2,1-2H3,(H,22,23)
InChIKeyUFRGRUJZODCMSK-UHFFFAOYSA-N
MW327.38 g/mol
LogP4.15
Rot. Bonds5

About N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine

N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine (PubChem CID 15272240) has the molecular formula C19H19F2N3 and a molecular weight of 327.38 g/mol. Its IUPAC name is N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine
PubChem CID15272240
Molecular FormulaC19H19F2N3
Molecular Weight327.38 g/mol
Exact Mass327.15
IUPAC NameN-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine
SMILESCN(C)CCNc1cc(-c2ccccc2F)nc2ccc(F)cc12
InChIInChI=1S/C19H19F2N3/c1-24(2)10-9-22-18-12-19(14-5-3-4-6-16(14)21)23-17-8-7-13(20)11-15(17)18/h3-8,11-12H,9-10H2,1-2H3,(H,22,23)
InChIKeyUFRGRUJZODCMSK-UHFFFAOYSA-N
XLogP4.15
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine?
The IUPAC name of N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine (CID 15272240) is N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine?
The canonical SMILES for N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine is CN(C)CCNc1cc(-c2ccccc2F)nc2ccc(F)cc12.
What is the InChIKey of N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine?
The InChIKey is UFRGRUJZODCMSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2N3/c1-24(2)10-9-22-18-12-19(14-5-3-4-6-16(14)21)23-17-8-7-13(20)11-15(17)18/h3-8,11-12H,9-10H2,1-2H3,(H,22,23).
What are the key properties of N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine?
N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine has a molecular weight of 327.38 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-fluoro-2-(2-fluorophenyl)quinolin-4-yl]-N',N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 15272240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).