N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine

C14H25NO2 — CID 113414265

IUPACN-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine
SMILESCCC1CCCC(OC2CCC(=NO)CC2)C1
InChIInChI=1S/C14H25NO2/c1-2-11-4-3-5-14(10-11)17-13-8-6-12(15-16)7-9-13/h11,13-14,16H,2-10H2,1H3/b15-12-
InChIKeyJLSKZDJRRJSCMB-QINSGFPZSA-N
MW239.36 g/mol
LogP3.74
Rot. Bonds3

About N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine

N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine (PubChem CID 113414265) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine.

Molecular Properties

Compound NameN-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine
PubChem CID113414265
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC NameN-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine
SMILESCCC1CCCC(OC2CCC(=NO)CC2)C1
InChIInChI=1S/C14H25NO2/c1-2-11-4-3-5-14(10-11)17-13-8-6-12(15-16)7-9-13/h11,13-14,16H,2-10H2,1H3/b15-12-
InChIKeyJLSKZDJRRJSCMB-QINSGFPZSA-N
XLogP3.74
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 53.74
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

(3S)-1-ethoxy-3-ethylcyclohexane
CID 144585145
(5S)-2-ethyl-5-[(1S)-3-ethylcyclohexyl]oxyoxane
CID 121307560
trans-(1S,3S)-1-ethyl-3-propan-2-yloxycyclohexane
CID 177191810
3-(3-ethylcyclohexyl)oxy-4-iodothiolane 1,1-dioxide
CID 114774333
1-(3-chloro-2,2-dimethylcyclobutyl)oxy-3-ethylcyclohexane
CID 66346004
1-(3-ethylcyclohexyl)oxyspiro[3.4]octan-3-one
CID 66368096
2-ethyl-3-(3-ethylcyclohexyl)oxy-2-methylcyclobutan-1-ol
CID 66345654
2-(3-ethylcyclohexyl)oxypropane-1,3-diol
CID 139529013
3-(3-ethylcyclohexyl)oxy-1-(methylamino)cyclohexane-1-carboxylic acid
CID 79637128
3-(3-ethylcyclohexyl)oxy-4-methylpiperidine
CID 102954193
2-(3-ethylcyclohexyl)oxy-6-fluoro-N'-hydroxybenzenecarboximidamide
CID 77034372
[(1S,3R)-3-ethylcyclohexyl]methanol
CID 14940078

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine?
The IUPAC name of N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine (CID 113414265) is N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine.
What is the SMILES notation for N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine?
The canonical SMILES for N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine is CCC1CCCC(OC2CCC(=NO)CC2)C1.
What is the InChIKey of N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine?
The InChIKey is JLSKZDJRRJSCMB-QINSGFPZSA-N. The full InChI is InChI=1S/C14H25NO2/c1-2-11-4-3-5-14(10-11)17-13-8-6-12(15-16)7-9-13/h11,13-14,16H,2-10H2,1H3/b15-12-.
What are the key properties of N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine?
N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine has a molecular weight of 239.36 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-ethylcyclohexyl)oxycyclohexylidene]hydroxylamine is sourced from PubChem (CID 113414265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).