N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine

C12H14FN3 — CID 83837097

IUPACN'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine
SMILESCN(CCN)c1ccc2cccc(F)c2n1
InChIInChI=1S/C12H14FN3/c1-16(8-7-14)11-6-5-9-3-2-4-10(13)12(9)15-11/h2-6H,7-8,14H2,1H3
InChIKeyMIZQZHIIRFMDLB-UHFFFAOYSA-N
MW219.26 g/mol
LogP1.77
Rot. Bonds3

About N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine

N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine (PubChem CID 83837097) has the molecular formula C12H14FN3 and a molecular weight of 219.26 g/mol. Its IUPAC name is N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine
PubChem CID83837097
Molecular FormulaC12H14FN3
Molecular Weight219.26 g/mol
Exact Mass219.12
IUPAC NameN'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine
SMILESCN(CCN)c1ccc2cccc(F)c2n1
InChIInChI=1S/C12H14FN3/c1-16(8-7-14)11-6-5-9-3-2-4-10(13)12(9)15-11/h2-6H,7-8,14H2,1H3
InChIKeyMIZQZHIIRFMDLB-UHFFFAOYSA-N
XLogP1.77
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine
CID 62593517
N'-(6-methoxy-2-pyridinyl)-N'-methylethane-1,2-diamine
CID 63590609
N'-(7-fluoro-1,3-benzoxazol-2-yl)-N'-methylethane-1,2-diamine
CID 83834384
N'-methyl-N'-(5,6,7,8-tetrahydroquinolin-2-yl)ethane-1,2-diamine
CID 19980268
2-N,2-N-diethylquinoline-2,8-diamine
CID 105469074
N'-(5-fluoro-2-pyridinyl)-N'-methylpropane-1,3-diamine
CID 61311958
2-[(6-fluoro-2-pyridinyl)-methylamino]ethanol
CID 61229567
N-(2-aminoethyl)-2,6-difluoro-N-methylbenzamide
CID 61350833
N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine
CID 62682578
6-[3-aminopropyl(methyl)amino]pyridine-2-carbonitrile
CID 115319464
N'-(5-tert-butyl-2-pyridinyl)-N'-methylethane-1,2-diamine
CID 107875067
6-fluoro-N-methyl-N-pentylpyridin-2-amine
CID 61230318

Frequently Asked Questions

What is the IUPAC name of N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine?
The IUPAC name of N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine (CID 83837097) is N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine is CN(CCN)c1ccc2cccc(F)c2n1.
What is the InChIKey of N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine?
The InChIKey is MIZQZHIIRFMDLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN3/c1-16(8-7-14)11-6-5-9-3-2-4-10(13)12(9)15-11/h2-6H,7-8,14H2,1H3.
What are the key properties of N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine?
N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine has a molecular weight of 219.26 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 83837097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).