1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine

C14H24N2 — CID 79092443

IUPAC1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine
SMILESCCNC(CN(C)C)c1cccc(C)c1C
InChIInChI=1S/C14H24N2/c1-6-15-14(10-16(4)5)13-9-7-8-11(2)12(13)3/h7-9,14-15H,6,10H2,1-5H3
InChIKeyYMDIIDPILCWELI-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.52
Rot. Bonds5

About 1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine

1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine (PubChem CID 79092443) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound Name1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine
PubChem CID79092443
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine
SMILESCCNC(CN(C)C)c1cccc(C)c1C
InChIInChI=1S/C14H24N2/c1-6-15-14(10-16(4)5)13-9-7-8-11(2)12(13)3/h7-9,14-15H,6,10H2,1-5H3
InChIKeyYMDIIDPILCWELI-UHFFFAOYSA-N
XLogP2.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dimethylphenyl)-N',N'-dimethyl-N-propylethane-1,2-diamine
CID 79088664
1-(2,3-dimethylphenyl)-N-ethyl-5-methylhexan-1-amine
CID 105028600
1-(2,3-dimethylphenyl)-N-ethylhexan-1-amine
CID 115837078
1-(2,3-dimethylphenyl)-N-ethyloctan-1-amine
CID 115832026
1-(2,3-dimethylphenyl)-N-ethyl-2-(thian-4-yl)ethanamine
CID 105140728
N-ethyl-N',N'-dimethyl-1-(7-methyl-1-benzofuran-2-yl)ethane-1,2-diamine
CID 114729711
2-cycloheptyl-1-(2,3-dimethylphenyl)-N-ethylethanamine
CID 115850456
N'-[2-(ethylamino)-2-(2-methylphenyl)ethyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63693986
N-ethyl-N',N'-dimethyl-1-(2-methylthiophen-3-yl)ethane-1,2-diamine
CID 102833204
1-(2,3-dimethylphenyl)-N-ethyl-4-methylsulfonylbutan-1-amine
CID 115820292
1-(2,3-dimethylphenyl)-N-ethyl-3-(furan-2-yl)propan-1-amine
CID 105140541
3-(2,3-dimethylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105259123

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine?
The IUPAC name of 1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine (CID 79092443) is 1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine.
What is the SMILES notation for 1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine?
The canonical SMILES for 1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine is CCNC(CN(C)C)c1cccc(C)c1C.
What is the InChIKey of 1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine?
The InChIKey is YMDIIDPILCWELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-6-15-14(10-16(4)5)13-9-7-8-11(2)12(13)3/h7-9,14-15H,6,10H2,1-5H3.
What are the key properties of 1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine?
1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine has a molecular weight of 220.36 g/mol, XLogP of 2.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylphenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 79092443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).