phenylmethoxy(1H-pyrazol-5-yl)diazene

C10H10N4O — CID 175140944

IUPACphenylmethoxy(1H-pyrazol-5-yl)diazene
SMILESc1ccc(CON=Nc2ccn[nH]2)cc1
InChIInChI=1S/C10H10N4O/c1-2-4-9(5-3-1)8-15-14-13-10-6-7-11-12-10/h1-7H,8H2,(H,11,12)
InChIKeyGTNNBIVYCPKCSE-UHFFFAOYSA-N
MW202.22 g/mol
LogP2.63
Rot. Bonds4

About phenylmethoxy(1H-pyrazol-5-yl)diazene

phenylmethoxy(1H-pyrazol-5-yl)diazene (PubChem CID 175140944) has the molecular formula C10H10N4O and a molecular weight of 202.22 g/mol. Its IUPAC name is phenylmethoxy(1H-pyrazol-5-yl)diazene.

Molecular Properties

Compound Namephenylmethoxy(1H-pyrazol-5-yl)diazene
PubChem CID175140944
Molecular FormulaC10H10N4O
Molecular Weight202.22 g/mol
Exact Mass202.09
IUPAC Namephenylmethoxy(1H-pyrazol-5-yl)diazene
SMILESc1ccc(CON=Nc2ccn[nH]2)cc1
InChIInChI=1S/C10H10N4O/c1-2-4-9(5-3-1)8-15-14-13-10-6-7-11-12-10/h1-7H,8H2,(H,11,12)
InChIKeyGTNNBIVYCPKCSE-UHFFFAOYSA-N
XLogP2.63
TPSA62.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', '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 phenylmethoxy(1H-pyrazol-5-yl)diazene?
The IUPAC name of phenylmethoxy(1H-pyrazol-5-yl)diazene (CID 175140944) is phenylmethoxy(1H-pyrazol-5-yl)diazene.
What is the SMILES notation for phenylmethoxy(1H-pyrazol-5-yl)diazene?
The canonical SMILES for phenylmethoxy(1H-pyrazol-5-yl)diazene is c1ccc(CON=Nc2ccn[nH]2)cc1.
What is the InChIKey of phenylmethoxy(1H-pyrazol-5-yl)diazene?
The InChIKey is GTNNBIVYCPKCSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O/c1-2-4-9(5-3-1)8-15-14-13-10-6-7-11-12-10/h1-7H,8H2,(H,11,12).
What are the key properties of phenylmethoxy(1H-pyrazol-5-yl)diazene?
phenylmethoxy(1H-pyrazol-5-yl)diazene has a molecular weight of 202.22 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for phenylmethoxy(1H-pyrazol-5-yl)diazene is sourced from PubChem (CID 175140944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).