O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine

C11H16N2O — CID 134285914

IUPACO-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine
SMILESCCC(/C=C(/N)ON)c1ccccc1
InChIInChI=1S/C11H16N2O/c1-2-9(8-11(12)14-13)10-6-4-3-5-7-10/h3-9H,2,12-13H2,1H3/b11-8-
InChIKeyLMAPSVMGSNGPIK-FLIBITNWSA-N
MW192.26 g/mol
LogP1.87
Rot. Bonds4

About O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine

O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine (PubChem CID 134285914) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine.

Molecular Properties

Compound NameO-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine
PubChem CID134285914
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC NameO-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine
SMILESCCC(/C=C(/N)ON)c1ccccc1
InChIInChI=1S/C11H16N2O/c1-2-9(8-11(12)14-13)10-6-4-3-5-7-10/h3-9H,2,12-13H2,1H3/b11-8-
InChIKeyLMAPSVMGSNGPIK-FLIBITNWSA-N
XLogP1.87
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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CID 19885763
amino 2-phenylbutanoate
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(1S,2S)-2-amino-1-phenylbutan-1-ol
CID 36689126
3-phenylpentan-2-yl carbamate
CID 70616482
(1S,2R)-1-phenylbutane-1,2-diamine
CID 10702186
(2R)-2-phenylbutanamide
CID 139147476
(E)-2-phenylpent-3-en-1-amine
CID 131236812
amino 2,3-dimethyl-4-phenylhexanoate
CID 58946320
(E)-3-phenylprop-2-enamide;1-phenylpropylbenzene
CID 142088142
[(E,2R)-4-ethoxypent-3-en-2-yl]benzene
CID 59915630
ethyl (2S)-2-phenylpropanoate
CID 7204861
benzyl (2S)-2-(benzylamino)butanoate
CID 59758756

Frequently Asked Questions

What is the IUPAC name of O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine?
The IUPAC name of O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine (CID 134285914) is O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine.
What is the SMILES notation for O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine?
The canonical SMILES for O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine is CCC(/C=C(/N)ON)c1ccccc1.
What is the InChIKey of O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine?
The InChIKey is LMAPSVMGSNGPIK-FLIBITNWSA-N. The full InChI is InChI=1S/C11H16N2O/c1-2-9(8-11(12)14-13)10-6-4-3-5-7-10/h3-9H,2,12-13H2,1H3/b11-8-.
What are the key properties of O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine?
O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine has a molecular weight of 192.26 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(Z)-1-amino-3-phenylpent-1-enyl]hydroxylamine is sourced from PubChem (CID 134285914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).