(Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride

C5H9FN2 — CID 146384592

IUPAC(Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride
SMILES[H]/N=C(F)/C(C)=C\NC
InChIInChI=1S/C5H9FN2/c1-4(3-8-2)5(6)7/h3,7-8H,1-2H3/b4-3-,7-5-
InChIKeyYQBQYCVATYSZOV-MRWCJKGFSA-N
MW116.14 g/mol
LogP1.06
Rot. Bonds2

About (Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride

(Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride (PubChem CID 146384592) has the molecular formula C5H9FN2 and a molecular weight of 116.14 g/mol. Its IUPAC name is (Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride.

Molecular Properties

Compound Name(Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride
PubChem CID146384592
Molecular FormulaC5H9FN2
Molecular Weight116.14 g/mol
Exact Mass116.07
IUPAC Name(Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride
SMILES[H]/N=C(F)/C(C)=C\NC
InChIInChI=1S/C5H9FN2/c1-4(3-8-2)5(6)7/h3,7-8H,1-2H3/b4-3-,7-5-
InChIKeyYQBQYCVATYSZOV-MRWCJKGFSA-N
XLogP1.06
TPSA35.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.14
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride?
The IUPAC name of (Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride (CID 146384592) is (Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride.
What is the SMILES notation for (Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride?
The canonical SMILES for (Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride is [H]/N=C(F)/C(C)=C\NC.
What is the InChIKey of (Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride?
The InChIKey is YQBQYCVATYSZOV-MRWCJKGFSA-N. The full InChI is InChI=1S/C5H9FN2/c1-4(3-8-2)5(6)7/h3,7-8H,1-2H3/b4-3-,7-5-.
What are the key properties of (Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride?
(Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride has a molecular weight of 116.14 g/mol, XLogP of 1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-methyl-3-(methylamino)prop-2-enimidoyl fluoride is sourced from PubChem (CID 146384592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).