(NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine

C7H9N3O — CID 124502737

IUPAC(NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine
SMILESCNc1ccc(/C=N\O)cn1
InChIInChI=1S/C7H9N3O/c1-8-7-3-2-6(4-9-7)5-10-11/h2-5,11H,1H3,(H,8,9)/b10-5-
InChIKeyRIJGIONGUATBFO-YHYXMXQVSA-N
MW151.17 g/mol
LogP0.93
Rot. Bonds2

About (NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine

(NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine (PubChem CID 124502737) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is (NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine
PubChem CID124502737
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name(NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine
SMILESCNc1ccc(/C=N\O)cn1
InChIInChI=1S/C7H9N3O/c1-8-7-3-2-6(4-9-7)5-10-11/h2-5,11H,1H3,(H,8,9)/b10-5-
InChIKeyRIJGIONGUATBFO-YHYXMXQVSA-N
XLogP0.93
TPSA57.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 50.93
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-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine (CID 124502737) is (NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine is CNc1ccc(/C=N\O)cn1.
What is the InChIKey of (NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine?
The InChIKey is RIJGIONGUATBFO-YHYXMXQVSA-N. The full InChI is InChI=1S/C7H9N3O/c1-8-7-3-2-6(4-9-7)5-10-11/h2-5,11H,1H3,(H,8,9)/b10-5-.
What are the key properties of (NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine?
(NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine has a molecular weight of 151.17 g/mol, XLogP of 0.93, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine is sourced from PubChem (CID 124502737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).