1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine

C14H24N2O2 — CID 116934991

IUPAC1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine
SMILESCCNCC(N)c1cc(OC)c(C)c(C)c1OC
InChIInChI=1S/C14H24N2O2/c1-6-16-8-12(15)11-7-13(17-4)9(2)10(3)14(11)18-5/h7,12,16H,6,8,15H2,1-5H3
InChIKeyHXQBLTJYTOAMLK-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.93
Rot. Bonds6

About 1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine

1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine (PubChem CID 116934991) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine.

Molecular Properties

Compound Name1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine
PubChem CID116934991
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine
SMILESCCNCC(N)c1cc(OC)c(C)c(C)c1OC
InChIInChI=1S/C14H24N2O2/c1-6-16-8-12(15)11-7-13(17-4)9(2)10(3)14(11)18-5/h7,12,16H,6,8,15H2,1-5H3
InChIKeyHXQBLTJYTOAMLK-UHFFFAOYSA-N
XLogP1.93
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4,5-dimethoxy-2-methylphenyl)-N'-ethylethane-1,2-diamine
CID 116934918
N'-ethyl-1-(2,4,5-trimethoxyphenyl)ethane-1,2-diamine
CID 116934954
N'-ethyl-1-(4-methoxy-2,3-dimethylphenyl)ethane-1,2-diamine
CID 116934913
methyl 2-(2,5-dimethoxy-3,4-dimethylphenyl)butanoate
CID 116964458
N'-ethyl-1-(2-methoxy-4-propan-2-ylphenyl)ethane-1,2-diamine
CID 116934906
N'-ethyl-1-(2-methoxy-4,6-dimethylphenyl)ethane-1,2-diamine
CID 116934935
1-(2,4-dimethoxy-6-methylphenyl)-N'-ethylethane-1,2-diamine
CID 116934957
1-(2,5-dimethoxy-3,4-dimethylphenyl)-N,N,N'-trimethylethane-1,2-diamine
CID 116855775
1-(2,4-dimethoxy-3-methylphenyl)-N'-ethyl-N-methylethane-1,2-diamine
CID 116950345
2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)acetohydrazide
CID 116848546
2-amino-2-(2,5-dimethoxy-3,4-dimethylphenyl)-N-methylacetamide
CID 116850472
(2,5-dimethoxy-3,4-dimethylphenyl)-(methylamino)methanol
CID 116954760

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine?
The IUPAC name of 1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine (CID 116934991) is 1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine.
What is the SMILES notation for 1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine?
The canonical SMILES for 1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine is CCNCC(N)c1cc(OC)c(C)c(C)c1OC.
What is the InChIKey of 1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine?
The InChIKey is HXQBLTJYTOAMLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-6-16-8-12(15)11-7-13(17-4)9(2)10(3)14(11)18-5/h7,12,16H,6,8,15H2,1-5H3.
What are the key properties of 1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine?
1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine has a molecular weight of 252.36 g/mol, XLogP of 1.93, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethoxy-3,4-dimethylphenyl)-N'-ethylethane-1,2-diamine is sourced from PubChem (CID 116934991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).