(NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine

C19H22N4O3 — CID 134834637

IUPAC(NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine
SMILESC/C(CN(C/C(=N\O)c1ccccc1)C/C(=N/O)c1ccccc1)=N/O
InChIInChI=1S/C19H22N4O3/c1-15(20-24)12-23(13-18(21-25)16-8-4-2-5-9-16)14-19(22-26)17-10-6-3-7-11-17/h2-11,24-26H,12-14H2,1H3/b20-15-,21-18-,22-19+
InChIKeyXLCAMYRSJUNNID-ZLUBXJHQSA-N
MW354.41 g/mol
LogP2.90
Rot. Bonds8

About (NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine

(NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine (PubChem CID 134834637) has the molecular formula C19H22N4O3 and a molecular weight of 354.41 g/mol. Its IUPAC name is (NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine
PubChem CID134834637
Molecular FormulaC19H22N4O3
Molecular Weight354.41 g/mol
Exact Mass354.17
IUPAC Name(NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine
SMILESC/C(CN(C/C(=N\O)c1ccccc1)C/C(=N/O)c1ccccc1)=N/O
InChIInChI=1S/C19H22N4O3/c1-15(20-24)12-23(13-18(21-25)16-8-4-2-5-9-16)14-19(22-26)17-10-6-3-7-11-17/h2-11,24-26H,12-14H2,1H3/b20-15-,21-18-,22-19+
InChIKeyXLCAMYRSJUNNID-ZLUBXJHQSA-N
XLogP2.90
TPSA101.01 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 52.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine (CID 134834637) is (NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine is C/C(CN(C/C(=N\O)c1ccccc1)C/C(=N/O)c1ccccc1)=N/O.
What is the InChIKey of (NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine?
The InChIKey is XLCAMYRSJUNNID-ZLUBXJHQSA-N. The full InChI is InChI=1S/C19H22N4O3/c1-15(20-24)12-23(13-18(21-25)16-8-4-2-5-9-16)14-19(22-26)17-10-6-3-7-11-17/h2-11,24-26H,12-14H2,1H3/b20-15-,21-18-,22-19+.
What are the key properties of (NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine?
(NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine has a molecular weight of 354.41 g/mol, XLogP of 2.90, 8 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[1-[[(2E)-2-hydroxyimino-2-phenylethyl]-[(2Z)-2-hydroxyimino-2-phenylethyl]amino]propan-2-ylidene]hydroxylamine is sourced from PubChem (CID 134834637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).