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

C15H24F2N2 — CID 2059067

IUPACN'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine
SMILESCCN(CC)CCN(CC)Cc1c(F)cccc1F
InChIInChI=1S/C15H24F2N2/c1-4-18(5-2)10-11-19(6-3)12-13-14(16)8-7-9-15(13)17/h7-9H,4-6,10-12H2,1-3H3
InChIKeyUGISJJOCNFJZOR-UHFFFAOYSA-N
MW270.37 g/mol
LogP3.13
Rot. Bonds8

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

N'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine (PubChem CID 2059067) has the molecular formula C15H24F2N2 and a molecular weight of 270.37 g/mol. Its IUPAC name is N'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine
PubChem CID2059067
Molecular FormulaC15H24F2N2
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC NameN'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine
SMILESCCN(CC)CCN(CC)Cc1c(F)cccc1F
InChIInChI=1S/C15H24F2N2/c1-4-18(5-2)10-11-19(6-3)12-13-14(16)8-7-9-15(13)17/h7-9H,4-6,10-12H2,1-3H3
InChIKeyUGISJJOCNFJZOR-UHFFFAOYSA-N
XLogP3.13
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-ethylethanamine
CID 63387036
3-[[(2,6-difluorophenyl)methyl-ethylamino]methyl]aniline
CID 115776980
4-(diethylamino)-1-(2,6-difluorophenyl)butan-2-ol
CID 114931570
3-[(2,6-difluorophenyl)methyl-ethylamino]-1-piperazin-1-ylpropan-1-one;hydrochloride
CID 120981439
N'-[(3-bromo-2,6-difluorophenyl)methyl]-N,N,N'-triethylpropane-1,3-diamine
CID 106269278
N',N'-diethyl-N-[(2-fluorophenyl)methyl]-N-methylethane-1,2-diamine
CID 783899
N-carbamoyl-2-[(2,6-difluorophenyl)methyl-ethylamino]acetamide
CID 52685012
2-[[ethyl(2-methylpropyl)amino]methyl]-3-fluoroaniline
CID 63330668
N'-[(2-amino-6-fluorophenyl)methyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 63331189
N-[(2-bromo-6-fluorophenyl)methyl]-N',N'-diethylethane-1,2-diamine
CID 114559162
2-[[ethyl(propyl)amino]methyl]-6-fluorophenol
CID 112616084
N'-[(2,6-difluorophenyl)methyl]-N'-methylethane-1,2-diamine
CID 62682578

Frequently Asked Questions

What is the IUPAC name of N'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine?
The IUPAC name of N'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine (CID 2059067) is N'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine.
What is the SMILES notation for N'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine?
The canonical SMILES for N'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine is CCN(CC)CCN(CC)Cc1c(F)cccc1F.
What is the InChIKey of N'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine?
The InChIKey is UGISJJOCNFJZOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24F2N2/c1-4-18(5-2)10-11-19(6-3)12-13-14(16)8-7-9-15(13)17/h7-9H,4-6,10-12H2,1-3H3.
What are the key properties of N'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine?
N'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine has a molecular weight of 270.37 g/mol, XLogP of 3.13, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(2,6-difluorophenyl)methyl]-N,N,N'-triethylethane-1,2-diamine is sourced from PubChem (CID 2059067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).