N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine

C12H20N2O — CID 43263333

IUPACN'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine
SMILESCCN(C)CC(N)c1ccccc1OC
InChIInChI=1S/C12H20N2O/c1-4-14(2)9-11(13)10-7-5-6-8-12(10)15-3/h5-8,11H,4,9,13H2,1-3H3
InChIKeyWGZBCSUFJFCOLQ-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.65
Rot. Bonds5

About N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine

N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine (PubChem CID 43263333) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine
PubChem CID43263333
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC NameN'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine
SMILESCCN(C)CC(N)c1ccccc1OC
InChIInChI=1S/C12H20N2O/c1-4-14(2)9-11(13)10-7-5-6-8-12(10)15-3/h5-8,11H,4,9,13H2,1-3H3
InChIKeyWGZBCSUFJFCOLQ-UHFFFAOYSA-N
XLogP1.65
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-butyl-N'-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine
CID 18070854
(1R)-1-(2-methoxyphenyl)propan-1-amine;hydrochloride
CID 53484779
1-(2-methoxyphenyl)-N'-methyl-N'-[(1-methylpyrrolidin-2-yl)methyl]ethane-1,2-diamine
CID 79313803
1-(2-ethoxyphenyl)-N'-methyl-N'-(2-methylbutyl)ethane-1,2-diamine
CID 43295700
N'-[2-(dimethylamino)ethyl]-1-(2-ethoxyphenyl)-N'-methylethane-1,2-diamine
CID 55228302
(1S)-1-(2-methoxyphenyl)ethane-1,2-diamine
CID 51699599
N'-ethyl-1-(2-methoxyphenyl)-N'-(3-methylphenyl)ethane-1,2-diamine
CID 61076765
2-amino-2-(2-methoxyphenyl)ethanol
CID 10352062
(1S)-1-(2-methoxyphenyl)propane-1,3-diamine
CID 171219974
3-ethyl-1-(2-methoxyphenyl)pentan-1-amine
CID 82919557
(1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine
CID 118327627
(1S)-4,4,4-trifluoro-1-(2-methoxyphenyl)butan-1-amine
CID 171219989

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine?
The IUPAC name of N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine (CID 43263333) is N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine is CCN(C)CC(N)c1ccccc1OC.
What is the InChIKey of N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine?
The InChIKey is WGZBCSUFJFCOLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-4-14(2)9-11(13)10-7-5-6-8-12(10)15-3/h5-8,11H,4,9,13H2,1-3H3.
What are the key properties of N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine?
N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine has a molecular weight of 208.31 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-1-(2-methoxyphenyl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 43263333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).