(NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine

C6H11NO2 — CID 126972218

IUPAC(NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine
SMILESCC1C/C(=N\O)CCO1
InChIInChI=1S/C6H11NO2/c1-5-4-6(7-8)2-3-9-5/h5,8H,2-4H2,1H3/b7-6-
InChIKeyKYGZOTCWQAPMQT-SREVYHEPSA-N
MW129.16 g/mol
LogP1.02
Rot. Bonds

About (NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine

(NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine (PubChem CID 126972218) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is (NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine
PubChem CID126972218
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC Name(NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine
SMILESCC1C/C(=N\O)CCO1
InChIInChI=1S/C6H11NO2/c1-5-4-6(7-8)2-3-9-5/h5,8H,2-4H2,1H3/b7-6-
InChIKeyKYGZOTCWQAPMQT-SREVYHEPSA-N
XLogP1.02
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-(2-methyloxan-4-ylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine (CID 126972218) is (NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine is CC1C/C(=N\O)CCO1.
What is the InChIKey of (NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine?
The InChIKey is KYGZOTCWQAPMQT-SREVYHEPSA-N. The full InChI is InChI=1S/C6H11NO2/c1-5-4-6(7-8)2-3-9-5/h5,8H,2-4H2,1H3/b7-6-.
What are the key properties of (NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine?
(NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine has a molecular weight of 129.16 g/mol, XLogP of 1.02, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(2-methyloxan-4-ylidene)hydroxylamine is sourced from PubChem (CID 126972218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).