N-cyclohexylidenehydroxylamine;octan-1-ol

C14H29NO2 — CID 174496993

IUPACN-cyclohexylidenehydroxylamine;octan-1-ol
SMILESCCCCCCCCO.ON=C1CCCCC1
InChIInChI=1S/C8H18O.C6H11NO/c1-2-3-4-5-6-7-8-9;8-7-6-4-2-1-3-5-6/h9H,2-8H2,1H3;8H,1-5H2
InChIKeyQJKVQOXYKJTYLK-UHFFFAOYSA-N
MW243.39 g/mol
LogP4.12
Rot. Bonds6

About N-cyclohexylidenehydroxylamine;octan-1-ol

N-cyclohexylidenehydroxylamine;octan-1-ol (PubChem CID 174496993) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is N-cyclohexylidenehydroxylamine;octan-1-ol.

Molecular Properties

Compound NameN-cyclohexylidenehydroxylamine;octan-1-ol
PubChem CID174496993
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC NameN-cyclohexylidenehydroxylamine;octan-1-ol
SMILESCCCCCCCCO.ON=C1CCCCC1
InChIInChI=1S/C8H18O.C6H11NO/c1-2-3-4-5-6-7-8-9;8-7-6-4-2-1-3-5-6/h9H,2-8H2,1H3;8H,1-5H2
InChIKeyQJKVQOXYKJTYLK-UHFFFAOYSA-N
XLogP4.12
TPSA52.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-cyclohexylidenehydroxylamine;hexane
CID 159104992
cyclopentane;heptan-1-ol
CID 67743397
cyclohexane;bis(pentan-1-ol)
CID 159060972
cycloheptane;bis(pentan-1-ol)
CID 140562210
cyclohexanone;pentan-1-ol
CID 70403425
N-cyclopentadecylidenehydroxylamine
CID 551985
cyclohexanone;N-cyclohexylidenehydroxylamine;hexanamide
CID 160555328
decane-1,10-diol;heptan-1-ol;nonan-1-ol;pentan-1-ol;tridecan-1-ol
CID 159582596
nonadecakis(heptane);nonan-1-ol
CID 173279398
heptan-1-ol;nonan-1-ol
CID 160785033
hexan-1-ol;nonane
CID 175106830
undecan-1-ol
CID 122455065

Frequently Asked Questions

What is the IUPAC name of N-cyclohexylidenehydroxylamine;octan-1-ol?
The IUPAC name of N-cyclohexylidenehydroxylamine;octan-1-ol (CID 174496993) is N-cyclohexylidenehydroxylamine;octan-1-ol.
What is the SMILES notation for N-cyclohexylidenehydroxylamine;octan-1-ol?
The canonical SMILES for N-cyclohexylidenehydroxylamine;octan-1-ol is CCCCCCCCO.ON=C1CCCCC1.
What is the InChIKey of N-cyclohexylidenehydroxylamine;octan-1-ol?
The InChIKey is QJKVQOXYKJTYLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O.C6H11NO/c1-2-3-4-5-6-7-8-9;8-7-6-4-2-1-3-5-6/h9H,2-8H2,1H3;8H,1-5H2.
What are the key properties of N-cyclohexylidenehydroxylamine;octan-1-ol?
N-cyclohexylidenehydroxylamine;octan-1-ol has a molecular weight of 243.39 g/mol, XLogP of 4.12, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylidenehydroxylamine;octan-1-ol is sourced from PubChem (CID 174496993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).