(NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine

C9H9N5O — CID 155681490

IUPAC(NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine
SMILESO/N=C(\Cn1cnnn1)c1ccccc1
InChIInChI=1S/C9H9N5O/c15-11-9(6-14-7-10-12-13-14)8-4-2-1-3-5-8/h1-5,7,15H,6H2/b11-9+
InChIKeyIGHMVXVWPBIRRC-PKNBQFBNSA-N
MW203.21 g/mol
LogP0.55
Rot. Bonds3

About (NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine

(NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine (PubChem CID 155681490) has the molecular formula C9H9N5O and a molecular weight of 203.21 g/mol. Its IUPAC name is (NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine
PubChem CID155681490
Molecular FormulaC9H9N5O
Molecular Weight203.21 g/mol
Exact Mass203.08
IUPAC Name(NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine
SMILESO/N=C(\Cn1cnnn1)c1ccccc1
InChIInChI=1S/C9H9N5O/c15-11-9(6-14-7-10-12-13-14)8-4-2-1-3-5-8/h1-5,7,15H,6H2/b11-9+
InChIKeyIGHMVXVWPBIRRC-PKNBQFBNSA-N
XLogP0.55
TPSA76.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.21
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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'}

Analyze (NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-phenyl-2-(tetrazol-1-yl)acetamide
CID 24977364
(NZ)-N-[(3E)-3-hydroxyimino-1,3-diphenylpropylidene]hydroxylamine
CID 6297502
N-methyl-N-phenyl-2-(tetrazol-1-yl)acetamide
CID 110856918
1-(2-chlorophenyl)-2-(tetrazol-1-yl)ethanone
CID 52914739
1-[(2Z)-2-hydroxyimino-2-phenylethyl]pyrrolidine-2,5-dione
CID 6420641
copper;2-hydroxyimino-2-phenylethanol
CID 88811267
(NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine
CID 139192653
2-[2-phenylethyl-[2-(tetrazol-1-yl)acetyl]amino]acetic acid
CID 119347669
2-phenyl-3-[[2-(tetrazol-1-yl)acetyl]amino]propanoic acid
CID 62883661
2-(tetrazol-1-yl)-N-[(1R)-2,2,2-trifluoro-1-phenylethyl]acetamide
CID 95639107
N-[(1S)-1,2-diphenylethyl]-2-(tetrazol-1-yl)acetamide
CID 9117476
4-phenyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-4-carboxylic acid
CID 119164517

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine (CID 155681490) is (NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine is O/N=C(\Cn1cnnn1)c1ccccc1.
What is the InChIKey of (NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine?
The InChIKey is IGHMVXVWPBIRRC-PKNBQFBNSA-N. The full InChI is InChI=1S/C9H9N5O/c15-11-9(6-14-7-10-12-13-14)8-4-2-1-3-5-8/h1-5,7,15H,6H2/b11-9+.
What are the key properties of (NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine?
(NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine has a molecular weight of 203.21 g/mol, XLogP of 0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[1-phenyl-2-(tetrazol-1-yl)ethylidene]hydroxylamine is sourced from PubChem (CID 155681490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).