[(E)-(1-amino-2-methylpropylidene)amino] hypofluorite

C4H9FN2O — CID 153378925

IUPAC[(E)-(1-amino-2-methylpropylidene)amino] hypofluorite
SMILESCC(C)/C(N)=N\OF
InChIInChI=1S/C4H9FN2O/c1-3(2)4(6)7-8-5/h3H,1-2H3,(H2,6,7)
InChIKeyOMDZXNXZVPMNAC-UHFFFAOYSA-N
MW120.13 g/mol
LogP0.82
Rot. Bonds2

About [(E)-(1-amino-2-methylpropylidene)amino] hypofluorite

[(E)-(1-amino-2-methylpropylidene)amino] hypofluorite (PubChem CID 153378925) has the molecular formula C4H9FN2O and a molecular weight of 120.13 g/mol. Its IUPAC name is [(E)-(1-amino-2-methylpropylidene)amino] hypofluorite.

Molecular Properties

Compound Name[(E)-(1-amino-2-methylpropylidene)amino] hypofluorite
PubChem CID153378925
Molecular FormulaC4H9FN2O
Molecular Weight120.13 g/mol
Exact Mass120.07
IUPAC Name[(E)-(1-amino-2-methylpropylidene)amino] hypofluorite
SMILESCC(C)/C(N)=N\OF
InChIInChI=1S/C4H9FN2O/c1-3(2)4(6)7-8-5/h3H,1-2H3,(H2,6,7)
InChIKeyOMDZXNXZVPMNAC-UHFFFAOYSA-N
XLogP0.82
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.13
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

CID 171370188
CID 171370188
N'-amino-2-methylpropanimidamide;dihydrochloride
CID 167730390
2-methyl-N'-[(1S)-1-(4-methylthiadiazol-5-yl)ethoxy]propanimidamide
CID 164642518
N'-[(Z)-1-amino-3-methylbut-1-en-2-yl]-2-methylpropanimidamide
CID 166933258
2-methyl-N'-(1,1,1-trifluoro-2-methylpropan-2-yl)propanimidamide
CID 130934515
N'-(2-methoxy-2-methylpropyl)-2-methylpropanimidamide
CID 104766079
N'-(2-hydroxyethyl)-2-methylpropanimidamide;hydrate
CID 172821400
[(E)-3-methylbutan-2-ylideneamino] carbamate
CID 143595167
[(E)-(4-methyl-3-oxopentan-2-ylidene)amino] acetate
CID 162411014
N'-(3-ethylpentan-2-yl)-2-methylpropanimidamide
CID 63841288
N'-(3,5-dimethoxyphenyl)-2-methylpropanimidamide
CID 63173838
N'-hydroxy-2-methoxypropanimidamide
CID 72581636

Frequently Asked Questions

What is the IUPAC name of [(E)-(1-amino-2-methylpropylidene)amino] hypofluorite?
The IUPAC name of [(E)-(1-amino-2-methylpropylidene)amino] hypofluorite (CID 153378925) is [(E)-(1-amino-2-methylpropylidene)amino] hypofluorite.
What is the SMILES notation for [(E)-(1-amino-2-methylpropylidene)amino] hypofluorite?
The canonical SMILES for [(E)-(1-amino-2-methylpropylidene)amino] hypofluorite is CC(C)/C(N)=N\OF.
What is the InChIKey of [(E)-(1-amino-2-methylpropylidene)amino] hypofluorite?
The InChIKey is OMDZXNXZVPMNAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9FN2O/c1-3(2)4(6)7-8-5/h3H,1-2H3,(H2,6,7).
What are the key properties of [(E)-(1-amino-2-methylpropylidene)amino] hypofluorite?
[(E)-(1-amino-2-methylpropylidene)amino] hypofluorite has a molecular weight of 120.13 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-(1-amino-2-methylpropylidene)amino] hypofluorite is sourced from PubChem (CID 153378925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).