N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine

C14H25NOS — CID 3469218

IUPACN-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine
SMILESON=C1CCCCCCC1SC1CCCCC1
InChIInChI=1S/C14H25NOS/c16-15-13-10-6-1-2-7-11-14(13)17-12-8-4-3-5-9-12/h12,14,16H,1-11H2
InChIKeySHAVGMFALXYJKX-UHFFFAOYSA-N
MW255.43 g/mol
LogP4.61
Rot. Bonds2

About N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine

N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine (PubChem CID 3469218) has the molecular formula C14H25NOS and a molecular weight of 255.43 g/mol. Its IUPAC name is N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine.

Molecular Properties

Compound NameN-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine
PubChem CID3469218
Molecular FormulaC14H25NOS
Molecular Weight255.43 g/mol
Exact Mass255.17
IUPAC NameN-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine
SMILESON=C1CCCCCCC1SC1CCCCC1
InChIInChI=1S/C14H25NOS/c16-15-13-10-6-1-2-7-11-14(13)17-12-8-4-3-5-9-12/h12,14,16H,1-11H2
InChIKeySHAVGMFALXYJKX-UHFFFAOYSA-N
XLogP4.61
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.43
LogP ≤ 54.61
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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Related Compounds

(NE)-N-(2-methylsulfanylcyclooctylidene)hydroxylamine
CID 12447280
2-(Ethylthio)cyclooctanone oxime
CID 9602636
(NE)-N-(2-methylsulfanylcyclododecylidene)hydroxylamine
CID 141118454
N-(2-cyclohexylsulfonylcyclooctylidene)hydroxylamine
CID 3431602
N-(2-decylsulfanylcyclooctylidene)hydroxylamine
CID 3435059
N-[2-(2-hexylsulfanylethylsulfanyl)cyclooctylidene]hydroxylamine
CID 4058319
N-(2-dodecylsulfanylcyclohexylidene)hydroxylamine
CID 4454955
N-[2-(2-butylsulfanylethylsulfanyl)cyclooctylidene]hydroxylamine
CID 4532877
N-(2-dodecylsulfanylcyclooctylidene)hydroxylamine
CID 4622270
N-(2-octylsulfanylcyclooctylidene)hydroxylamine
CID 5152145
(NZ)-N-(2-ethylsulfanylcyclooctylidene)hydroxylamine
CID 5370419
2-(Cyclohexylsulfonyl)-1-(hydroxyimino)cyclooctane
CID 5824434

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine?
The IUPAC name of N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine (CID 3469218) is N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine.
What is the SMILES notation for N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine?
The canonical SMILES for N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine is ON=C1CCCCCCC1SC1CCCCC1.
What is the InChIKey of N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine?
The InChIKey is SHAVGMFALXYJKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NOS/c16-15-13-10-6-1-2-7-11-14(13)17-12-8-4-3-5-9-12/h12,14,16H,1-11H2.
What are the key properties of N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine?
N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine has a molecular weight of 255.43 g/mol, XLogP of 4.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylsulfanylcyclooctylidene)hydroxylamine is sourced from PubChem (CID 3469218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).