(NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine

C14H25NO3S — CID 40630405

IUPAC(NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine
SMILESO=S(=O)(C1CCCCC1)[C@@H]1CCCCCC/C1=N/O
InChIInChI=1S/C14H25NO3S/c16-15-13-10-6-1-2-7-11-14(13)19(17,18)12-8-4-3-5-9-12/h12,14,16H,1-11H2/b15-13-/t14-/m1/s1
InChIKeyLVDDNFQZVVOOQH-JNINTMOKSA-N
MW287.43 g/mol
LogP3.29
Rot. Bonds2

About (NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine

(NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine (PubChem CID 40630405) has the molecular formula C14H25NO3S and a molecular weight of 287.43 g/mol. Its IUPAC name is (NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine
PubChem CID40630405
Molecular FormulaC14H25NO3S
Molecular Weight287.43 g/mol
Exact Mass287.16
IUPAC Name(NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine
SMILESO=S(=O)(C1CCCCC1)[C@@H]1CCCCCC/C1=N/O
InChIInChI=1S/C14H25NO3S/c16-15-13-10-6-1-2-7-11-14(13)19(17,18)12-8-4-3-5-9-12/h12,14,16H,1-11H2/b15-13-/t14-/m1/s1
InChIKeyLVDDNFQZVVOOQH-JNINTMOKSA-N
XLogP3.29
TPSA66.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.43
LogP ≤ 53.29
H-Bond Donors ≤ 51
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-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine (CID 40630405) is (NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine is O=S(=O)(C1CCCCC1)[C@@H]1CCCCCC/C1=N/O.
What is the InChIKey of (NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine?
The InChIKey is LVDDNFQZVVOOQH-JNINTMOKSA-N. The full InChI is InChI=1S/C14H25NO3S/c16-15-13-10-6-1-2-7-11-14(13)19(17,18)12-8-4-3-5-9-12/h12,14,16H,1-11H2/b15-13-/t14-/m1/s1.
What are the key properties of (NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine?
(NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine has a molecular weight of 287.43 g/mol, XLogP of 3.29, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine is sourced from PubChem (CID 40630405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).