2-[2-(dimethylamino)ethyl]guanidine

C5H14N4 — CID 26500

IUPAC2-[2-(dimethylamino)ethyl]guanidine
SMILESCN(C)CCN=C(N)N
InChIInChI=1S/C5H14N4/c1-9(2)4-3-8-5(6)7/h3-4H2,1-2H3,(H4,6,7,8)
InChIKeyJKCZLILBALEVRB-UHFFFAOYSA-N
MW130.19 g/mol
LogP-1.18
Rot. Bonds3

About 2-[2-(dimethylamino)ethyl]guanidine

2-[2-(dimethylamino)ethyl]guanidine (PubChem CID 26500) has the molecular formula C5H14N4 and a molecular weight of 130.19 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethyl]guanidine.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethyl]guanidine
PubChem CID26500
Molecular FormulaC5H14N4
Molecular Weight130.19 g/mol
Exact Mass130.12
IUPAC Name2-[2-(dimethylamino)ethyl]guanidine
SMILESCN(C)CCN=C(N)N
InChIInChI=1S/C5H14N4/c1-9(2)4-3-8-5(6)7/h3-4H2,1-2H3,(H4,6,7,8)
InChIKeyJKCZLILBALEVRB-UHFFFAOYSA-N
XLogP-1.18
TPSA67.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-1.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N'',N'''-Ethane-1,2-diyldiguanidine
CID 25831
N-Ethylimidodicarbonimidic diamide
CID 16446
1-Ethyl-3-(3-dimethylaminoethyl)carbodiimide
CID 122346
N-(2-Diethylamino-ethyl)-guanidine
CID 18645
2-[1-(Diaminomethylideneamino)ethyl]guanidine
CID 19742602
2-(Diaminomethylideneamino)ethyl-trimethylazanium
CID 56290
2-(Diaminomethylideneamino)ethyl-diethyl-methylazanium
CID 56359
1-(2-(Diethylamino)ethyl)guanidine hydriodide
CID 24838560
Diaminomethylidene(diethyl)azanium
CID 5243947
2-[2-(Methylamino)ethyl]guanidine
CID 6713590
N,N-dimethyl-2-(methyliminomethylideneamino)ethanamine
CID 14633812
2-(N'-ethylcarbamimidoyl)-1,1-dimethylguanidine
CID 21027222

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethyl]guanidine?
The IUPAC name of 2-[2-(dimethylamino)ethyl]guanidine (CID 26500) is 2-[2-(dimethylamino)ethyl]guanidine.
What is the SMILES notation for 2-[2-(dimethylamino)ethyl]guanidine?
The canonical SMILES for 2-[2-(dimethylamino)ethyl]guanidine is CN(C)CCN=C(N)N.
What is the InChIKey of 2-[2-(dimethylamino)ethyl]guanidine?
The InChIKey is JKCZLILBALEVRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N4/c1-9(2)4-3-8-5(6)7/h3-4H2,1-2H3,(H4,6,7,8).
What are the key properties of 2-[2-(dimethylamino)ethyl]guanidine?
2-[2-(dimethylamino)ethyl]guanidine has a molecular weight of 130.19 g/mol, XLogP of -1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethyl]guanidine is sourced from PubChem (CID 26500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).