N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine

C14H24N2O — CID 61448002

IUPACN'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine
SMILESCCN(CCOC)CC(N)c1ccc(C)cc1
InChIInChI=1S/C14H24N2O/c1-4-16(9-10-17-3)11-14(15)13-7-5-12(2)6-8-13/h5-8,14H,4,9-11,15H2,1-3H3
InChIKeyLVKUZMUYSQTPNE-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.96
Rot. Bonds7

About N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine

N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine (PubChem CID 61448002) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine
PubChem CID61448002
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine
SMILESCCN(CCOC)CC(N)c1ccc(C)cc1
InChIInChI=1S/C14H24N2O/c1-4-16(9-10-17-3)11-14(15)13-7-5-12(2)6-8-13/h5-8,14H,4,9-11,15H2,1-3H3
InChIKeyLVKUZMUYSQTPNE-UHFFFAOYSA-N
XLogP1.96
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-(2-methylpropyl)ethane-1,2-diamine
CID 54986790
N'-[2-amino-2-(4-methylphenyl)ethyl]-N,N,N'-triethylpropane-1,3-diamine
CID 102992533
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-ethyl-N'-(2-methoxyethyl)ethane-1,2-diamine
CID 61448308
N',N'-diethyl-1-(4-methylphenyl)propane-1,3-diamine
CID 62619570
N'-(2-methoxyethyl)-N'-(2-methylpropyl)-1-phenylethane-1,2-diamine
CID 55138914
N'-ethyl-N'-(2-methylbutyl)-1-(4-methylphenyl)propane-1,3-diamine
CID 79481346
N'-ethyl-N'-(2-methoxyethyl)-1-[2-(trifluoromethyl)phenyl]ethane-1,2-diamine
CID 107520238
(2S)-1-N-ethyl-1-N-(2-methoxyethyl)propane-1,2-diamine
CID 103934538
N'-(2-ethoxyethyl)-N'-ethyl-1-[4-(trifluoromethyl)phenyl]ethane-1,2-diamine
CID 107521259
1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol
CID 79038389
2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1-(4-methylphenyl)ethanamine
CID 104560552
N'-(2-amino-2-phenylethyl)-N,N,N'-triethylpropane-1,3-diamine
CID 102992514

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine?
The IUPAC name of N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine (CID 61448002) is N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine is CCN(CCOC)CC(N)c1ccc(C)cc1.
What is the InChIKey of N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine?
The InChIKey is LVKUZMUYSQTPNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-16(9-10-17-3)11-14(15)13-7-5-12(2)6-8-13/h5-8,14H,4,9-11,15H2,1-3H3.
What are the key properties of N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine?
N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine has a molecular weight of 236.36 g/mol, XLogP of 1.96, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine is sourced from PubChem (CID 61448002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).