(NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine

C7H11NO2 — CID 21331661

IUPAC(NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine
SMILESCOC1=CCCC/C1=N/O
InChIInChI=1S/C7H11NO2/c1-10-7-5-3-2-4-6(7)8-9/h5,9H,2-4H2,1H3/b8-6-
InChIKeyDOKTVWYVWXVNGB-VURMDHGXSA-N
MW141.17 g/mol
LogP1.53
Rot. Bonds1

About (NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine

(NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine (PubChem CID 21331661) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is (NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine
PubChem CID21331661
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC Name(NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine
SMILESCOC1=CCCC/C1=N/O
InChIInChI=1S/C7H11NO2/c1-10-7-5-3-2-4-6(7)8-9/h5,9H,2-4H2,1H3/b8-6-
InChIKeyDOKTVWYVWXVNGB-VURMDHGXSA-N
XLogP1.53
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 51.53
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-methoxycyclohex-2-en-1-ylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine (CID 21331661) is (NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine is COC1=CCCC/C1=N/O.
What is the InChIKey of (NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine?
The InChIKey is DOKTVWYVWXVNGB-VURMDHGXSA-N. The full InChI is InChI=1S/C7H11NO2/c1-10-7-5-3-2-4-6(7)8-9/h5,9H,2-4H2,1H3/b8-6-.
What are the key properties of (NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine?
(NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine has a molecular weight of 141.17 g/mol, XLogP of 1.53, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(2-methoxycyclohex-2-en-1-ylidene)hydroxylamine is sourced from PubChem (CID 21331661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).