N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine

C11H18N2O — CID 62066193

IUPACN-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine
SMILESCCNC(CN)c1ccccc1OC
InChIInChI=1S/C11H18N2O/c1-3-13-10(8-12)9-6-4-5-7-11(9)14-2/h4-7,10,13H,3,8,12H2,1-2H3
InChIKeyROSRTHYQCDCAJX-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.30
Rot. Bonds5

About N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine

N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine (PubChem CID 62066193) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine
PubChem CID62066193
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC NameN-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine
SMILESCCNC(CN)c1ccccc1OC
InChIInChI=1S/C11H18N2O/c1-3-13-10(8-12)9-6-4-5-7-11(9)14-2/h4-7,10,13H,3,8,12H2,1-2H3
InChIKeyROSRTHYQCDCAJX-UHFFFAOYSA-N
XLogP1.30
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(difluoromethoxy)phenyl]-N-ethylethane-1,2-diamine
CID 62066384
1-(2-methoxyphenyl)-N-prop-2-ynylethane-1,2-diamine
CID 65380773
1-(2-methoxyphenyl)-N-(3-methyl-2-propan-2-ylbutyl)ethane-1,2-diamine
CID 102912491
N-[2-(dimethylamino)ethyl]-1-(2-methoxyphenyl)ethane-1,2-diamine
CID 65385216
N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine
CID 103024885
2-cyclopropyl-N-ethyl-1-(2-methoxyphenyl)ethanamine
CID 64904236
N-ethyl-4,4,4-trifluoro-1-(2-methoxyphenyl)butan-1-amine
CID 64567616
1-(2-chloro-6-methoxyphenyl)-N-ethylethane-1,2-diamine
CID 104816313
N,N',N'-triethyl-1-(2-methoxyphenyl)propane-1,3-diamine
CID 79087347
2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine
CID 63414322
1-(2-methoxyphenyl)-N-[2-(2-methylprop-2-enoxy)ethyl]ethane-1,2-diamine
CID 114466724
N-ethyl-1-(2-methoxyphenyl)-N'-(3-methoxypropyl)-N'-methylethane-1,2-diamine
CID 62985012

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine?
The IUPAC name of N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine (CID 62066193) is N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine.
What is the SMILES notation for N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine?
The canonical SMILES for N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine is CCNC(CN)c1ccccc1OC.
What is the InChIKey of N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine?
The InChIKey is ROSRTHYQCDCAJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-3-13-10(8-12)9-6-4-5-7-11(9)14-2/h4-7,10,13H,3,8,12H2,1-2H3.
What are the key properties of N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine?
N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine has a molecular weight of 194.28 g/mol, XLogP of 1.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine is sourced from PubChem (CID 62066193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).