N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine

C13H30N2O — CID 62574591

IUPACN-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
SMILESCOCCNCCN(CC(C)C)CC(C)C
InChIInChI=1S/C13H30N2O/c1-12(2)10-15(11-13(3)4)8-6-14-7-9-16-5/h12-14H,6-11H2,1-5H3
InChIKeyNNFRBAYFGXKUFZ-UHFFFAOYSA-N
MW230.40 g/mol
LogP1.84
Rot. Bonds10

About N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine

N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine (PubChem CID 62574591) has the molecular formula C13H30N2O and a molecular weight of 230.40 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
PubChem CID62574591
Molecular FormulaC13H30N2O
Molecular Weight230.40 g/mol
Exact Mass230.24
IUPAC NameN-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
SMILESCOCCNCCN(CC(C)C)CC(C)C
InChIInChI=1S/C13H30N2O/c1-12(2)10-15(11-13(3)4)8-6-14-7-9-16-5/h12-14H,6-11H2,1-5H3
InChIKeyNNFRBAYFGXKUFZ-UHFFFAOYSA-N
XLogP1.84
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.40
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N'-ethyl-N-(3-methoxypropyl)-N'-(2-methylpropyl)ethane-1,2-diamine
CID 62575773
N'-ethyl-N-(2-methoxyethyl)-N'-(2-methylbutyl)ethane-1,2-diamine
CID 79482433
N-(2-ethoxyethyl)-N'-ethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 62575445
N'-ethyl-N'-(2-ethylbutyl)-N-(2-methoxyethyl)ethane-1,2-diamine
CID 62574596
N',N'-bis(2-methoxyethyl)-N-(2-methylpropyl)ethane-1,2-diamine
CID 62462476
N'-[2-(dimethylamino)ethyl]-N-(2-methoxyethyl)-N'-propylethane-1,2-diamine
CID 62574418
3-[[2-hydroxy-3-(2-methoxyethylamino)propyl]-(2-methylpropyl)amino]propanenitrile
CID 113317541
N-(2-methoxyethyl)-5-methylhexan-1-amine
CID 62603286
N-(cyclopropylmethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
CID 61378857
N-benzyl-N'-(2-methoxyethyl)-N'-(2-methylpropyl)ethane-1,2-diamine
CID 55089880
N'-ethyl-N'-(2-methylpropyl)-N-propylethane-1,2-diamine
CID 61386594
N'-butyl-N'-ethyl-N-(2-methoxyethyl)ethane-1,2-diamine
CID 62575465

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine?
The IUPAC name of N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine (CID 62574591) is N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine.
What is the SMILES notation for N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine?
The canonical SMILES for N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine is COCCNCCN(CC(C)C)CC(C)C.
What is the InChIKey of N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine?
The InChIKey is NNFRBAYFGXKUFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O/c1-12(2)10-15(11-13(3)4)8-6-14-7-9-16-5/h12-14H,6-11H2,1-5H3.
What are the key properties of N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine?
N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine has a molecular weight of 230.40 g/mol, XLogP of 1.84, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine is sourced from PubChem (CID 62574591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).