N,N-diethyl-2-methylprop-2-enimidamide

C8H16N2 — CID 150428392

IUPACN,N-diethyl-2-methylprop-2-enimidamide
SMILES[H]/N=C(\C(=C)C)N(CC)CC
InChIInChI=1S/C8H16N2/c1-5-10(6-2)8(9)7(3)4/h9H,3,5-6H2,1-2,4H3/b9-8+
InChIKeyHJGFNUQBRMYYPA-CMDGGOBGSA-N
MW140.23 g/mol
LogP1.88
Rot. Bonds3

About N,N-diethyl-2-methylprop-2-enimidamide

N,N-diethyl-2-methylprop-2-enimidamide (PubChem CID 150428392) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N,N-diethyl-2-methylprop-2-enimidamide.

Molecular Properties

Compound NameN,N-diethyl-2-methylprop-2-enimidamide
PubChem CID150428392
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN,N-diethyl-2-methylprop-2-enimidamide
SMILES[H]/N=C(\C(=C)C)N(CC)CC
InChIInChI=1S/C8H16N2/c1-5-10(6-2)8(9)7(3)4/h9H,3,5-6H2,1-2,4H3/b9-8+
InChIKeyHJGFNUQBRMYYPA-CMDGGOBGSA-N
XLogP1.88
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 N,N-diethyl-2-methylprop-2-enimidamide?
The IUPAC name of N,N-diethyl-2-methylprop-2-enimidamide (CID 150428392) is N,N-diethyl-2-methylprop-2-enimidamide.
What is the SMILES notation for N,N-diethyl-2-methylprop-2-enimidamide?
The canonical SMILES for N,N-diethyl-2-methylprop-2-enimidamide is [H]/N=C(\C(=C)C)N(CC)CC.
What is the InChIKey of N,N-diethyl-2-methylprop-2-enimidamide?
The InChIKey is HJGFNUQBRMYYPA-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H16N2/c1-5-10(6-2)8(9)7(3)4/h9H,3,5-6H2,1-2,4H3/b9-8+.
What are the key properties of N,N-diethyl-2-methylprop-2-enimidamide?
N,N-diethyl-2-methylprop-2-enimidamide has a molecular weight of 140.23 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-methylprop-2-enimidamide is sourced from PubChem (CID 150428392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).