N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine

C10H14F2N2 — CID 62682578

IUPACN'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine
SMILESCN(CCN)Cc1c(F)cccc1F
InChIInChI=1S/C10H14F2N2/c1-14(6-5-13)7-8-9(11)3-2-4-10(8)12/h2-4H,5-7,13H2,1H3
InChIKeyJPXWYOFKFNCDPV-UHFFFAOYSA-N
MW200.23 g/mol
LogP1.36
Rot. Bonds4

About N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine

N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine (PubChem CID 62682578) has the molecular formula C10H14F2N2 and a molecular weight of 200.23 g/mol. Its IUPAC name is N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine
PubChem CID62682578
Molecular FormulaC10H14F2N2
Molecular Weight200.23 g/mol
Exact Mass200.11
IUPAC NameN'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine
SMILESCN(CCN)Cc1c(F)cccc1F
InChIInChI=1S/C10H14F2N2/c1-14(6-5-13)7-8-9(11)3-2-4-10(8)12/h2-4H,5-7,13H2,1H3
InChIKeyJPXWYOFKFNCDPV-UHFFFAOYSA-N
XLogP1.36
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.23
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2,6-difluorophenyl)methyl]-N-methylacetamide
CID 166206862
methyl 2-[(2,6-difluorophenyl)methyl-methylamino]acetate
CID 115880448
N'-benzyl-N'-methylethane-1,2-diamine
CID 3014812
1-N-[(2,6-difluorophenyl)methyl]-4-fluoro-1-N-methylbenzene-1,3-diamine
CID 59268598
N-(2-aminoethyl)-2,6-difluoro-N-methylbenzamide
CID 61350833
N'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine
CID 2059067
N'-[(2-bromo-3-fluorophenyl)methyl]-N'-methylpropane-1,3-diamine
CID 115319274
1-[2-[2-[(dimethylamino)methyl]-3-fluorophenyl]-6-fluorophenyl]-N,N-dimethylmethanamine
CID 122228827
cis-(1S,2R)-2-[[(2,6-difluorophenyl)methyl-methylamino]methyl]cyclopentan-1-ol
CID 124515968
cis-(1R,2S)-2-[[(2,6-difluorophenyl)methyl-methylamino]methyl]cyclopentan-1-ol
CID 125136229
N'-[(4-chloro-3-fluorophenyl)methyl]-N'-methylethane-1,2-diamine
CID 62680595
N'-[2-(2-fluorophenoxy)ethyl]-N'-methylethane-1,2-diamine
CID 62686273

Frequently Asked Questions

What is the IUPAC name of N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine?
The IUPAC name of N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine (CID 62682578) is N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine.
What is the SMILES notation for N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine?
The canonical SMILES for N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine is CN(CCN)Cc1c(F)cccc1F.
What is the InChIKey of N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine?
The InChIKey is JPXWYOFKFNCDPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2N2/c1-14(6-5-13)7-8-9(11)3-2-4-10(8)12/h2-4H,5-7,13H2,1H3.
What are the key properties of N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine?
N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine has a molecular weight of 200.23 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine is sourced from PubChem (CID 62682578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).