(Z)-2-propan-2-ylidenepent-3-enimidamide

C8H14N2 — CID 130178565

IUPAC(Z)-2-propan-2-ylidenepent-3-enimidamide
SMILES[H]/N=C(\N)C(/C=C\C)=C(C)C
InChIInChI=1S/C8H14N2/c1-4-5-7(6(2)3)8(9)10/h4-5H,1-3H3,(H3,9,10)/b5-4-
InChIKeyRFXUIWSSVWQDMJ-PLNGDYQASA-N
MW138.21 g/mol
LogP1.83
Rot. Bonds2

About (Z)-2-propan-2-ylidenepent-3-enimidamide

(Z)-2-propan-2-ylidenepent-3-enimidamide (PubChem CID 130178565) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is (Z)-2-propan-2-ylidenepent-3-enimidamide.

Molecular Properties

Compound Name(Z)-2-propan-2-ylidenepent-3-enimidamide
PubChem CID130178565
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name(Z)-2-propan-2-ylidenepent-3-enimidamide
SMILES[H]/N=C(\N)C(/C=C\C)=C(C)C
InChIInChI=1S/C8H14N2/c1-4-5-7(6(2)3)8(9)10/h4-5H,1-3H3,(H3,9,10)/b5-4-
InChIKeyRFXUIWSSVWQDMJ-PLNGDYQASA-N
XLogP1.83
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.83
H-Bond Donors ≤ 52
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': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-propan-2-ylidenepent-3-enimidamide?
The IUPAC name of (Z)-2-propan-2-ylidenepent-3-enimidamide (CID 130178565) is (Z)-2-propan-2-ylidenepent-3-enimidamide.
What is the SMILES notation for (Z)-2-propan-2-ylidenepent-3-enimidamide?
The canonical SMILES for (Z)-2-propan-2-ylidenepent-3-enimidamide is [H]/N=C(\N)C(/C=C\C)=C(C)C.
What is the InChIKey of (Z)-2-propan-2-ylidenepent-3-enimidamide?
The InChIKey is RFXUIWSSVWQDMJ-PLNGDYQASA-N. The full InChI is InChI=1S/C8H14N2/c1-4-5-7(6(2)3)8(9)10/h4-5H,1-3H3,(H3,9,10)/b5-4-.
What are the key properties of (Z)-2-propan-2-ylidenepent-3-enimidamide?
(Z)-2-propan-2-ylidenepent-3-enimidamide has a molecular weight of 138.21 g/mol, XLogP of 1.83, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-propan-2-ylidenepent-3-enimidamide is sourced from PubChem (CID 130178565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).