N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine

C8H12FN3 — CID 62593517

IUPACN'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine
SMILESCN(CCN)c1ccc(F)cn1
InChIInChI=1S/C8H12FN3/c1-12(5-4-10)8-3-2-7(9)6-11-8/h2-3,6H,4-5,10H2,1H3
InChIKeyKPSHRSJGBFVEDS-UHFFFAOYSA-N
MW169.20 g/mol
LogP0.62
Rot. Bonds3

About N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine

N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine (PubChem CID 62593517) has the molecular formula C8H12FN3 and a molecular weight of 169.20 g/mol. Its IUPAC name is N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine
PubChem CID62593517
Molecular FormulaC8H12FN3
Molecular Weight169.20 g/mol
Exact Mass169.10
IUPAC NameN'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine
SMILESCN(CCN)c1ccc(F)cn1
InChIInChI=1S/C8H12FN3/c1-12(5-4-10)8-3-2-7(9)6-11-8/h2-3,6H,4-5,10H2,1H3
InChIKeyKPSHRSJGBFVEDS-UHFFFAOYSA-N
XLogP0.62
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.20
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(5-fluoro-2-pyridinyl)-N'-methylpropane-1,3-diamine
CID 61311958
N'-(5-fluoro-2-pyridinyl)-N'-propylethane-1,2-diamine
CID 63766650
N'-(5-tert-butyl-2-pyridinyl)-N'-methylethane-1,2-diamine
CID 107875067
1-(5-fluoro-2-pyridinyl)-1-methylhydrazine
CID 53403009
4-[(5-fluoro-2-pyridinyl)-methylamino]butanoic acid
CID 83835208
3-[(5-fluoro-2-pyridinyl)-methylamino]-N'-hydroxy-2-methylpropanimidamide
CID 76910802
5-fluoro-N-methyl-N-(1H-pyrazol-5-ylmethyl)pyridin-2-amine
CID 126786822
N'-methyl-N'-(5-methyl-2-pyridinyl)pentane-1,5-diamine
CID 107206914
N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine
CID 83837097
3-[[(5-fluoro-2-pyridinyl)-methylamino]methyl]benzonitrile
CID 62968970
N'-(5-tert-butyl-2-pyridinyl)-N'-methylpentane-1,5-diamine
CID 107875723
N'-[4-(4-fluorophenyl)-5-methylpyrimidin-2-yl]-N'-methylethane-1,2-diamine
CID 103279381

Frequently Asked Questions

What is the IUPAC name of N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine?
The IUPAC name of N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine (CID 62593517) is N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine is CN(CCN)c1ccc(F)cn1.
What is the InChIKey of N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine?
The InChIKey is KPSHRSJGBFVEDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12FN3/c1-12(5-4-10)8-3-2-7(9)6-11-8/h2-3,6H,4-5,10H2,1H3.
What are the key properties of N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine?
N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine has a molecular weight of 169.20 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5-fluoro-2-pyridinyl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 62593517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).