(NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine

C10H12N2O2 — CID 135545668

IUPAC(NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine
SMILESC/C(=N/O)c1ccc(/C(C)=N/O)cc1
InChIInChI=1S/C10H12N2O2/c1-7(11-13)9-3-5-10(6-4-9)8(2)12-14/h3-6,13-14H,1-2H3/b11-7-,12-8+
InChIKeyZTPGKYXCUIPQGC-NTLHZVPKSA-N
MW192.22 g/mol
LogP2.08
Rot. Bonds2

About (NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine

(NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine (PubChem CID 135545668) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is (NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine
PubChem CID135545668
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name(NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine
SMILESC/C(=N/O)c1ccc(/C(C)=N/O)cc1
InChIInChI=1S/C10H12N2O2/c1-7(11-13)9-3-5-10(6-4-9)8(2)12-14/h3-6,13-14H,1-2H3/b11-7-,12-8+
InChIKeyZTPGKYXCUIPQGC-NTLHZVPKSA-N
XLogP2.08
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine (CID 135545668) is (NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine is C/C(=N/O)c1ccc(/C(C)=N/O)cc1.
What is the InChIKey of (NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine?
The InChIKey is ZTPGKYXCUIPQGC-NTLHZVPKSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-7(11-13)9-3-5-10(6-4-9)8(2)12-14/h3-6,13-14H,1-2H3/b11-7-,12-8+.
What are the key properties of (NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine?
(NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine has a molecular weight of 192.22 g/mol, XLogP of 2.08, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[1-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine is sourced from PubChem (CID 135545668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).