(NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine

C9H15NO — CID 88732581

IUPAC(NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine
SMILESCC/C=C1/CCCC/C1=N\O
InChIInChI=1S/C9H15NO/c1-2-5-8-6-3-4-7-9(8)10-11/h5,11H,2-4,6-7H2,1H3/b8-5-,10-9+
InChIKeySHNZQPAVTYGGOY-RGPKZFNQSA-N
MW153.22 g/mol
LogP2.73
Rot. Bonds1

About (NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine

(NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine (PubChem CID 88732581) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is (NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine.

Molecular Properties

Compound Name(NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine
PubChem CID88732581
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name(NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine
SMILESCC/C=C1/CCCC/C1=N\O
InChIInChI=1S/C9H15NO/c1-2-5-8-6-3-4-7-9(8)10-11/h5,11H,2-4,6-7H2,1H3/b8-5-,10-9+
InChIKeySHNZQPAVTYGGOY-RGPKZFNQSA-N
XLogP2.73
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 (NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine?
The IUPAC name of (NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine (CID 88732581) is (NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine.
What is the SMILES notation for (NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine?
The canonical SMILES for (NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine is CC/C=C1/CCCC/C1=N\O.
What is the InChIKey of (NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine?
The InChIKey is SHNZQPAVTYGGOY-RGPKZFNQSA-N. The full InChI is InChI=1S/C9H15NO/c1-2-5-8-6-3-4-7-9(8)10-11/h5,11H,2-4,6-7H2,1H3/b8-5-,10-9+.
What are the key properties of (NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine?
(NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine has a molecular weight of 153.22 g/mol, XLogP of 2.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-[(2Z)-2-propylidenecyclohexylidene]hydroxylamine is sourced from PubChem (CID 88732581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).