N',2-dimethyl-N-prop-1-en-2-ylpropanimidamide

C8H16N2 — CID 89152922

IUPACN',2-dimethyl-N-prop-1-en-2-ylpropanimidamide
SMILESC=C(C)N/C(=N/C)C(C)C
InChIInChI=1S/C8H16N2/c1-6(2)8(9-5)10-7(3)4/h6H,3H2,1-2,4-5H3,(H,9,10)
InChIKeyZSWKAEIBADYVBP-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.79
Rot. Bonds2

About N',2-dimethyl-N-prop-1-en-2-ylpropanimidamide

N',2-dimethyl-N-prop-1-en-2-ylpropanimidamide (PubChem CID 89152922) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N',2-dimethyl-N-prop-1-en-2-ylpropanimidamide.

Molecular Properties

Compound NameN',2-dimethyl-N-prop-1-en-2-ylpropanimidamide
PubChem CID89152922
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN',2-dimethyl-N-prop-1-en-2-ylpropanimidamide
SMILESC=C(C)N/C(=N/C)C(C)C
InChIInChI=1S/C8H16N2/c1-6(2)8(9-5)10-7(3)4/h6H,3H2,1-2,4-5H3,(H,9,10)
InChIKeyZSWKAEIBADYVBP-UHFFFAOYSA-N
XLogP1.79
TPSA24.39 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 ≤ 51.79
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',2-dimethyl-N-prop-1-en-2-ylpropanimidamide?
The IUPAC name of N',2-dimethyl-N-prop-1-en-2-ylpropanimidamide (CID 89152922) is N',2-dimethyl-N-prop-1-en-2-ylpropanimidamide.
What is the SMILES notation for N',2-dimethyl-N-prop-1-en-2-ylpropanimidamide?
The canonical SMILES for N',2-dimethyl-N-prop-1-en-2-ylpropanimidamide is C=C(C)N/C(=N/C)C(C)C.
What is the InChIKey of N',2-dimethyl-N-prop-1-en-2-ylpropanimidamide?
The InChIKey is ZSWKAEIBADYVBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-6(2)8(9-5)10-7(3)4/h6H,3H2,1-2,4-5H3,(H,9,10).
What are the key properties of N',2-dimethyl-N-prop-1-en-2-ylpropanimidamide?
N',2-dimethyl-N-prop-1-en-2-ylpropanimidamide has a molecular weight of 140.23 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N',2-dimethyl-N-prop-1-en-2-ylpropanimidamide is sourced from PubChem (CID 89152922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).