N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine

C14H25NO3S — CID 3431602

IUPACN-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine
SMILESO=S(=O)(C1CCCCC1)C1CCCCCCC1=NO
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
InChIKeyLVDDNFQZVVOOQH-UHFFFAOYSA-N
MW287.43 g/mol
LogP3.29
Rot. Bonds2

About N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine

N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine (PubChem CID 3431602) has the molecular formula C14H25NO3S and a molecular weight of 287.43 g/mol. Its IUPAC name is N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine.

Molecular Properties

Compound NameN-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine
PubChem CID3431602
Molecular FormulaC14H25NO3S
Molecular Weight287.43 g/mol
Exact Mass287.16
IUPAC NameN-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine
SMILESO=S(=O)(C1CCCCC1)C1CCCCCCC1=NO
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
InChIKeyLVDDNFQZVVOOQH-UHFFFAOYSA-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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Related Compounds

N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine
CID 3469218
N-(2-decylsulfonylcyclooctylidene)hydroxylamine
CID 3591161
N-(2-octylsulfonylcyclooctylidene)hydroxylamine
CID 4402279
N-(2-pentylsulfonylcyclododecylidene)hydroxylamine
CID 4434595
2-(Cyclohexylsulfonyl)-1-(hydroxyimino)cyclooctane
CID 5824434
2-Cyclohexylthio-1-(hydroxyimino)cyclooctane
CID 5835397
2-(Decylsulfonyl)-1-(hydroxyimino)cyclooctane
CID 5869399
1-(Hydroxyimino)-2-(octylsulfonyl)cyclooctane
CID 6091093
1-(Hydroxyimino)-2-(pentylsulfonyl)cyclododecane
CID 6109527
(NZ)-N-[(2R)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine
CID 40630405
(NZ)-N-[(2R)-2-cyclohexylsulfanylcyclooctylidene]hydroxylamine
CID 40630406
(NZ)-N-[(2S)-2-cyclohexylsulfonylcyclooctylidene]hydroxylamine
CID 40630407

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine?
The IUPAC name of N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine (CID 3431602) is N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine.
What is the SMILES notation for N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine?
The canonical SMILES for N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine is O=S(=O)(C1CCCCC1)C1CCCCCCC1=NO.
What is the InChIKey of N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine?
The InChIKey is LVDDNFQZVVOOQH-UHFFFAOYSA-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.
What are the key properties of N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine?
N-(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 N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine is sourced from PubChem (CID 3431602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).