(Z,1E)-N-hydroxypent-2-enimidoyl fluoride

C5H8FNO — CID 172945410

IUPAC(Z,1E)-N-hydroxypent-2-enimidoyl fluoride
SMILESCC/C=C\C(F)=N/O
InChIInChI=1S/C5H8FNO/c1-2-3-4-5(6)7-8/h3-4,8H,2H2,1H3/b4-3-,7-5+
InChIKeyYXEGSZFQDAJGFA-QVXLNCAUSA-N
MW117.12 g/mol
LogP1.71
Rot. Bonds2

About (Z,1E)-N-hydroxypent-2-enimidoyl fluoride

(Z,1E)-N-hydroxypent-2-enimidoyl fluoride (PubChem CID 172945410) has the molecular formula C5H8FNO and a molecular weight of 117.12 g/mol. Its IUPAC name is (Z,1E)-N-hydroxypent-2-enimidoyl fluoride.

Molecular Properties

Compound Name(Z,1E)-N-hydroxypent-2-enimidoyl fluoride
PubChem CID172945410
Molecular FormulaC5H8FNO
Molecular Weight117.12 g/mol
Exact Mass117.06
IUPAC Name(Z,1E)-N-hydroxypent-2-enimidoyl fluoride
SMILESCC/C=C\C(F)=N/O
InChIInChI=1S/C5H8FNO/c1-2-3-4-5(6)7-8/h3-4,8H,2H2,1H3/b4-3-,7-5+
InChIKeyYXEGSZFQDAJGFA-QVXLNCAUSA-N
XLogP1.71
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.12
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(NZ)-N-[(E)-pent-3-en-2-ylidene]hydroxylamine
CID 101070438
Pent-3-en-2-one oxime
CID 119096111
(NE)-N-[(Z)-1,1,1-trifluoropent-3-en-2-ylidene]hydroxylamine
CID 134242121
Hepten-2-one oxime
CID 85773318
(Prop-1-enyl)ketoxime
CID 129758060
(NZ)-N-[(Z)-hept-3-en-2-ylidene]hydroxylamine
CID 89672912
N-pent-3-en-2-ylidenehydroxylamine
CID 139631450
N-hex-3-en-2-ylidenehydroxylamine
CID 145857943
(NE)-N-[(Z)-pent-3-en-2-ylidene]hydroxylamine
CID 154517287
ethane;(NZ)-N-[(Z)-pent-3-en-2-ylidene]hydroxylamine
CID 155751390
(NZ)-N-[(Z)-pent-3-en-2-ylidene]hydroxylamine
CID 155751391

Frequently Asked Questions

What is the IUPAC name of (Z,1E)-N-hydroxypent-2-enimidoyl fluoride?
The IUPAC name of (Z,1E)-N-hydroxypent-2-enimidoyl fluoride (CID 172945410) is (Z,1E)-N-hydroxypent-2-enimidoyl fluoride.
What is the SMILES notation for (Z,1E)-N-hydroxypent-2-enimidoyl fluoride?
The canonical SMILES for (Z,1E)-N-hydroxypent-2-enimidoyl fluoride is CC/C=C\C(F)=N/O.
What is the InChIKey of (Z,1E)-N-hydroxypent-2-enimidoyl fluoride?
The InChIKey is YXEGSZFQDAJGFA-QVXLNCAUSA-N. The full InChI is InChI=1S/C5H8FNO/c1-2-3-4-5(6)7-8/h3-4,8H,2H2,1H3/b4-3-,7-5+.
What are the key properties of (Z,1E)-N-hydroxypent-2-enimidoyl fluoride?
(Z,1E)-N-hydroxypent-2-enimidoyl fluoride has a molecular weight of 117.12 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,1E)-N-hydroxypent-2-enimidoyl fluoride is sourced from PubChem (CID 172945410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).