(E)-N',3,4-trimethylpent-2-enimidamide

C8H16N2 — CID 138495432

IUPAC(E)-N',3,4-trimethylpent-2-enimidamide
SMILESC/N=C(N)/C=C(\C)C(C)C
InChIInChI=1S/C8H16N2/c1-6(2)7(3)5-8(9)10-4/h5-6H,1-4H3,(H2,9,10)/b7-5+
InChIKeyNEPJOEXVAXAOKE-FNORWQNLSA-N
MW140.23 g/mol
LogP1.58
Rot. Bonds2

About (E)-N',3,4-trimethylpent-2-enimidamide

(E)-N',3,4-trimethylpent-2-enimidamide (PubChem CID 138495432) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (E)-N',3,4-trimethylpent-2-enimidamide.

Molecular Properties

Compound Name(E)-N',3,4-trimethylpent-2-enimidamide
PubChem CID138495432
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(E)-N',3,4-trimethylpent-2-enimidamide
SMILESC/N=C(N)/C=C(\C)C(C)C
InChIInChI=1S/C8H16N2/c1-6(2)7(3)5-8(9)10-4/h5-6H,1-4H3,(H2,9,10)/b7-5+
InChIKeyNEPJOEXVAXAOKE-FNORWQNLSA-N
XLogP1.58
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.58
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 (E)-N',3,4-trimethylpent-2-enimidamide?
The IUPAC name of (E)-N',3,4-trimethylpent-2-enimidamide (CID 138495432) is (E)-N',3,4-trimethylpent-2-enimidamide.
What is the SMILES notation for (E)-N',3,4-trimethylpent-2-enimidamide?
The canonical SMILES for (E)-N',3,4-trimethylpent-2-enimidamide is C/N=C(N)/C=C(\C)C(C)C.
What is the InChIKey of (E)-N',3,4-trimethylpent-2-enimidamide?
The InChIKey is NEPJOEXVAXAOKE-FNORWQNLSA-N. The full InChI is InChI=1S/C8H16N2/c1-6(2)7(3)5-8(9)10-4/h5-6H,1-4H3,(H2,9,10)/b7-5+.
What are the key properties of (E)-N',3,4-trimethylpent-2-enimidamide?
(E)-N',3,4-trimethylpent-2-enimidamide has a molecular weight of 140.23 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N',3,4-trimethylpent-2-enimidamide is sourced from PubChem (CID 138495432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).