N-ethyl-N'-methyl-N-propan-2-ylethanimidamide

C8H18N2 — CID 135162408

IUPACN-ethyl-N'-methyl-N-propan-2-ylethanimidamide
SMILESCCN(/C(C)=N/C)C(C)C
InChIInChI=1S/C8H18N2/c1-6-10(7(2)3)8(4)9-5/h7H,6H2,1-5H3/b9-8+
InChIKeyJFHGQPDTKOUTFB-CMDGGOBGSA-N
MW142.25 g/mol
LogP1.76
Rot. Bonds2

About N-ethyl-N'-methyl-N-propan-2-ylethanimidamide

N-ethyl-N'-methyl-N-propan-2-ylethanimidamide (PubChem CID 135162408) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is N-ethyl-N'-methyl-N-propan-2-ylethanimidamide.

Molecular Properties

Compound NameN-ethyl-N'-methyl-N-propan-2-ylethanimidamide
PubChem CID135162408
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC NameN-ethyl-N'-methyl-N-propan-2-ylethanimidamide
SMILESCCN(/C(C)=N/C)C(C)C
InChIInChI=1S/C8H18N2/c1-6-10(7(2)3)8(4)9-5/h7H,6H2,1-5H3/b9-8+
InChIKeyJFHGQPDTKOUTFB-CMDGGOBGSA-N
XLogP1.76
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 51.76
H-Bond Donors ≤ 50
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-ethyl-N'-methyl-N-propan-2-ylethanimidamide?
The IUPAC name of N-ethyl-N'-methyl-N-propan-2-ylethanimidamide (CID 135162408) is N-ethyl-N'-methyl-N-propan-2-ylethanimidamide.
What is the SMILES notation for N-ethyl-N'-methyl-N-propan-2-ylethanimidamide?
The canonical SMILES for N-ethyl-N'-methyl-N-propan-2-ylethanimidamide is CCN(/C(C)=N/C)C(C)C.
What is the InChIKey of N-ethyl-N'-methyl-N-propan-2-ylethanimidamide?
The InChIKey is JFHGQPDTKOUTFB-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H18N2/c1-6-10(7(2)3)8(4)9-5/h7H,6H2,1-5H3/b9-8+.
What are the key properties of N-ethyl-N'-methyl-N-propan-2-ylethanimidamide?
N-ethyl-N'-methyl-N-propan-2-ylethanimidamide has a molecular weight of 142.25 g/mol, XLogP of 1.76, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N'-methyl-N-propan-2-ylethanimidamide is sourced from PubChem (CID 135162408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).