N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine

C7H19N3O — CID 15685487

IUPACN'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine
SMILESCOCCNCCNCCN
InChIInChI=1S/C7H19N3O/c1-11-7-6-10-5-4-9-3-2-8/h9-10H,2-8H2,1H3
InChIKeyQAVQXVBLTOFQED-UHFFFAOYSA-N
MW161.25 g/mol
LogP-1.23
Rot. Bonds8

About N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine

N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine (PubChem CID 15685487) has the molecular formula C7H19N3O and a molecular weight of 161.25 g/mol. Its IUPAC name is N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine
PubChem CID15685487
Molecular FormulaC7H19N3O
Molecular Weight161.25 g/mol
Exact Mass161.15
IUPAC NameN'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine
SMILESCOCCNCCNCCN
InChIInChI=1S/C7H19N3O/c1-11-7-6-10-5-4-9-3-2-8/h9-10H,2-8H2,1H3
InChIKeyQAVQXVBLTOFQED-UHFFFAOYSA-N
XLogP-1.23
TPSA59.31 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 5-1.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Bis(2-Methoxyethyl)amine
CID 2383
1-Oxa-4,7,10-triazacyclododecane
CID 771596
(2-Methoxyethyl)(methyl)amine
CID 300977
Methyl(2-(morpholin-4-yl)ethyl)amine
CID 14979282
N-(2-Methoxyethyl)ethylamine
CID 546877
1-(2-Methoxyethyl)piperazine
CID 2734638
1-(2-Ethoxyethyl)piperazine
CID 2734643
2-[(2-Methoxyethyl)amino]acetonitrile
CID 21872496
(2-Ethoxyethyl)(ethyl)amine
CID 520890
1,2-Ethanediamine, N,N-bis(2-methoxyethyl)-
CID 7138275
(3-Aminopropyl)(2-methoxyethyl)amine
CID 10975518
N-Ethyl-2-(morpholin-4-yl)ethan-1-amine
CID 14518967

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine?
The IUPAC name of N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine (CID 15685487) is N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine.
What is the SMILES notation for N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine?
The canonical SMILES for N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine is COCCNCCNCCN.
What is the InChIKey of N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine?
The InChIKey is QAVQXVBLTOFQED-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19N3O/c1-11-7-6-10-5-4-9-3-2-8/h9-10H,2-8H2,1H3.
What are the key properties of N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine?
N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine has a molecular weight of 161.25 g/mol, XLogP of -1.23, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine is sourced from PubChem (CID 15685487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).