2-[ethyl(methyl)amino]ethanimidamide

C5H13N3 — CID 20703196

IUPAC2-[ethyl(methyl)amino]ethanimidamide
SMILES[H]/N=C(\N)CN(C)CC
InChIInChI=1S/C5H13N3/c1-3-8(2)4-5(6)7/h3-4H2,1-2H3,(H3,6,7)
InChIKeyRUBAYGALHDSBLB-UHFFFAOYSA-N
MW115.18 g/mol
LogP-0.13
Rot. Bonds3

About 2-[ethyl(methyl)amino]ethanimidamide

2-[ethyl(methyl)amino]ethanimidamide (PubChem CID 20703196) has the molecular formula C5H13N3 and a molecular weight of 115.18 g/mol. Its IUPAC name is 2-[ethyl(methyl)amino]ethanimidamide.

Molecular Properties

Compound Name2-[ethyl(methyl)amino]ethanimidamide
PubChem CID20703196
Molecular FormulaC5H13N3
Molecular Weight115.18 g/mol
Exact Mass115.11
IUPAC Name2-[ethyl(methyl)amino]ethanimidamide
SMILES[H]/N=C(\N)CN(C)CC
InChIInChI=1S/C5H13N3/c1-3-8(2)4-5(6)7/h3-4H2,1-2H3,(H3,6,7)
InChIKeyRUBAYGALHDSBLB-UHFFFAOYSA-N
XLogP-0.13
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 5-0.13
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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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(methyl)amino]ethanimidamide?
The IUPAC name of 2-[ethyl(methyl)amino]ethanimidamide (CID 20703196) is 2-[ethyl(methyl)amino]ethanimidamide.
What is the SMILES notation for 2-[ethyl(methyl)amino]ethanimidamide?
The canonical SMILES for 2-[ethyl(methyl)amino]ethanimidamide is [H]/N=C(\N)CN(C)CC.
What is the InChIKey of 2-[ethyl(methyl)amino]ethanimidamide?
The InChIKey is RUBAYGALHDSBLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N3/c1-3-8(2)4-5(6)7/h3-4H2,1-2H3,(H3,6,7).
What are the key properties of 2-[ethyl(methyl)amino]ethanimidamide?
2-[ethyl(methyl)amino]ethanimidamide has a molecular weight of 115.18 g/mol, XLogP of -0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(methyl)amino]ethanimidamide is sourced from PubChem (CID 20703196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).