(NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine

C11H14N2O — CID 22214530

IUPAC(NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine
SMILESO/N=C(/c1ccccc1)N1CCCC1
InChIInChI=1S/C11H14N2O/c14-12-11(13-8-4-5-9-13)10-6-2-1-3-7-10/h1-3,6-7,14H,4-5,8-9H2/b12-11-
InChIKeyXNWTYKOIWYPTBM-QXMHVHEDSA-N
MW190.25 g/mol
LogP1.92
Rot. Bonds1

About (NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine

(NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine (PubChem CID 22214530) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is (NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine
PubChem CID22214530
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name(NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine
SMILESO/N=C(/c1ccccc1)N1CCCC1
InChIInChI=1S/C11H14N2O/c14-12-11(13-8-4-5-9-13)10-6-2-1-3-7-10/h1-3,6-7,14H,4-5,8-9H2/b12-11-
InChIKeyXNWTYKOIWYPTBM-QXMHVHEDSA-N
XLogP1.92
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', '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-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine (CID 22214530) is (NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine is O/N=C(/c1ccccc1)N1CCCC1.
What is the InChIKey of (NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine?
The InChIKey is XNWTYKOIWYPTBM-QXMHVHEDSA-N. The full InChI is InChI=1S/C11H14N2O/c14-12-11(13-8-4-5-9-13)10-6-2-1-3-7-10/h1-3,6-7,14H,4-5,8-9H2/b12-11-.
What are the key properties of (NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine?
(NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine has a molecular weight of 190.25 g/mol, XLogP of 1.92, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[phenyl(pyrrolidin-1-yl)methylidene]hydroxylamine is sourced from PubChem (CID 22214530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).