(NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine

C9H8F3NO — CID 6373975

IUPAC(NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine
SMILESO/N=C(/Cc1ccccc1)C(F)(F)F
InChIInChI=1S/C9H8F3NO/c10-9(11,12)8(13-14)6-7-4-2-1-3-5-7/h1-5,14H,6H2/b13-8-
InChIKeyUKDFYZOIGYLVCH-JYRVWZFOSA-N
MW203.16 g/mol
LogP2.62
Rot. Bonds2

About (NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine

(NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine (PubChem CID 6373975) has the molecular formula C9H8F3NO and a molecular weight of 203.16 g/mol. Its IUPAC name is (NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine
PubChem CID6373975
Molecular FormulaC9H8F3NO
Molecular Weight203.16 g/mol
Exact Mass203.06
IUPAC Name(NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine
SMILESO/N=C(/Cc1ccccc1)C(F)(F)F
InChIInChI=1S/C9H8F3NO/c10-9(11,12)8(13-14)6-7-4-2-1-3-5-7/h1-5,14H,6H2/b13-8-
InChIKeyUKDFYZOIGYLVCH-JYRVWZFOSA-N
XLogP2.62
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.16
LogP ≤ 52.62
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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Frequently Asked Questions

What is the IUPAC name of (NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine (CID 6373975) is (NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine is O/N=C(/Cc1ccccc1)C(F)(F)F.
What is the InChIKey of (NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine?
The InChIKey is UKDFYZOIGYLVCH-JYRVWZFOSA-N. The full InChI is InChI=1S/C9H8F3NO/c10-9(11,12)8(13-14)6-7-4-2-1-3-5-7/h1-5,14H,6H2/b13-8-.
What are the key properties of (NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine?
(NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine has a molecular weight of 203.16 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(1,1,1-trifluoro-3-phenylpropan-2-ylidene)hydroxylamine is sourced from PubChem (CID 6373975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).