N-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide

C8H14N2 — CID 89034885

IUPACN-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide
SMILESC=C(C)/N=C(\C)N=C(C)C
InChIInChI=1S/C8H14N2/c1-6(2)9-8(5)10-7(3)4/h1H2,2-5H3/b9-8+
InChIKeyCVHNTKRDOZPXKO-CMDGGOBGSA-N
MW138.21 g/mol
LogP2.42
Rot. Bonds1

About N-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide

N-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide (PubChem CID 89034885) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is N-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide.

Molecular Properties

Compound NameN-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide
PubChem CID89034885
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC NameN-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide
SMILESC=C(C)/N=C(\C)N=C(C)C
InChIInChI=1S/C8H14N2/c1-6(2)9-8(5)10-7(3)4/h1H2,2-5H3/b9-8+
InChIKeyCVHNTKRDOZPXKO-CMDGGOBGSA-N
XLogP2.42
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.42
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-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide?
The IUPAC name of N-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide (CID 89034885) is N-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide.
What is the SMILES notation for N-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide?
The canonical SMILES for N-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide is C=C(C)/N=C(\C)N=C(C)C.
What is the InChIKey of N-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide?
The InChIKey is CVHNTKRDOZPXKO-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H14N2/c1-6(2)9-8(5)10-7(3)4/h1H2,2-5H3/b9-8+.
What are the key properties of N-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide?
N-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide has a molecular weight of 138.21 g/mol, XLogP of 2.42, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-ylidene-N'-prop-1-en-2-ylethanimidamide is sourced from PubChem (CID 89034885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).