N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene

C11H24N2 — CID 144528328

IUPACN-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene
SMILESC=C(C)C(C)(C)C.CCN/C=N/C
InChIInChI=1S/C7H14.C4H10N2/c1-6(2)7(3,4)5;1-3-6-4-5-2/h1H2,2-5H3;4H,3H2,1-2H3,(H,5,6)
InChIKeyJWZOFCJOULZHRZ-UHFFFAOYSA-N
MW184.33 g/mol
LogP2.86
Rot. Bonds2

About N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene

N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene (PubChem CID 144528328) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene.

Molecular Properties

Compound NameN-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene
PubChem CID144528328
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene
SMILESC=C(C)C(C)(C)C.CCN/C=N/C
InChIInChI=1S/C7H14.C4H10N2/c1-6(2)7(3,4)5;1-3-6-4-5-2/h1H2,2-5H3;4H,3H2,1-2H3,(H,5,6)
InChIKeyJWZOFCJOULZHRZ-UHFFFAOYSA-N
XLogP2.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 52.86
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1,2-dimethyl-3-[(E)-2,3,3-trimethylbut-1-enyl]guanidine
CID 132133932
N'-methyl-N-[(E)-2,3,3-trimethylbut-1-enyl]methanimidamide
CID 138630855
ethane;N-ethyl-N'-(2-methylprop-2-enyl)methanimidamide
CID 143326378
N-[2-(methylideneamino)ethyl]-N'-(2-methylidenebutyl)methanimidamide
CID 163971310

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene?
The IUPAC name of N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene (CID 144528328) is N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene.
What is the SMILES notation for N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene?
The canonical SMILES for N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene is C=C(C)C(C)(C)C.CCN/C=N/C.
What is the InChIKey of N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene?
The InChIKey is JWZOFCJOULZHRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14.C4H10N2/c1-6(2)7(3,4)5;1-3-6-4-5-2/h1H2,2-5H3;4H,3H2,1-2H3,(H,5,6).
What are the key properties of N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene?
N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene has a molecular weight of 184.33 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N'-methylmethanimidamide;2,3,3-trimethylbut-1-ene is sourced from PubChem (CID 144528328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).