(E)-4-fluoro-2-methylpent-3-enimidamide

C6H11FN2 — CID 142083241

IUPAC(E)-4-fluoro-2-methylpent-3-enimidamide
SMILES[H]/N=C(\N)C(C)/C=C(\C)F
InChIInChI=1S/C6H11FN2/c1-4(6(8)9)3-5(2)7/h3-4H,1-2H3,(H3,8,9)/b5-3+
InChIKeyUCDFZIQRKDGJEH-HWKANZROSA-N
MW130.17 g/mol
LogP1.43
Rot. Bonds2

About (E)-4-fluoro-2-methylpent-3-enimidamide

(E)-4-fluoro-2-methylpent-3-enimidamide (PubChem CID 142083241) has the molecular formula C6H11FN2 and a molecular weight of 130.17 g/mol. Its IUPAC name is (E)-4-fluoro-2-methylpent-3-enimidamide.

Molecular Properties

Compound Name(E)-4-fluoro-2-methylpent-3-enimidamide
PubChem CID142083241
Molecular FormulaC6H11FN2
Molecular Weight130.17 g/mol
Exact Mass130.09
IUPAC Name(E)-4-fluoro-2-methylpent-3-enimidamide
SMILES[H]/N=C(\N)C(C)/C=C(\C)F
InChIInChI=1S/C6H11FN2/c1-4(6(8)9)3-5(2)7/h3-4H,1-2H3,(H3,8,9)/b5-3+
InChIKeyUCDFZIQRKDGJEH-HWKANZROSA-N
XLogP1.43
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.17
LogP ≤ 51.43
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'}

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Frequently Asked Questions

What is the IUPAC name of (E)-4-fluoro-2-methylpent-3-enimidamide?
The IUPAC name of (E)-4-fluoro-2-methylpent-3-enimidamide (CID 142083241) is (E)-4-fluoro-2-methylpent-3-enimidamide.
What is the SMILES notation for (E)-4-fluoro-2-methylpent-3-enimidamide?
The canonical SMILES for (E)-4-fluoro-2-methylpent-3-enimidamide is [H]/N=C(\N)C(C)/C=C(\C)F.
What is the InChIKey of (E)-4-fluoro-2-methylpent-3-enimidamide?
The InChIKey is UCDFZIQRKDGJEH-HWKANZROSA-N. The full InChI is InChI=1S/C6H11FN2/c1-4(6(8)9)3-5(2)7/h3-4H,1-2H3,(H3,8,9)/b5-3+.
What are the key properties of (E)-4-fluoro-2-methylpent-3-enimidamide?
(E)-4-fluoro-2-methylpent-3-enimidamide has a molecular weight of 130.17 g/mol, XLogP of 1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-fluoro-2-methylpent-3-enimidamide is sourced from PubChem (CID 142083241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).