cyclohexyl (1E)-N-hydroxyethanimidate

C8H15NO2 — CID 175672760

IUPACcyclohexyl (1E)-N-hydroxyethanimidate
SMILESC/C(=N\O)OC1CCCCC1
InChIInChI=1S/C8H15NO2/c1-7(9-10)11-8-5-3-2-4-6-8/h8,10H,2-6H2,1H3/b9-7+
InChIKeyXWDWMOXBUOKLOZ-VQHVLOKHSA-N
MW157.21 g/mol
LogP2.14
Rot. Bonds1

About cyclohexyl (1E)-N-hydroxyethanimidate

cyclohexyl (1E)-N-hydroxyethanimidate (PubChem CID 175672760) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is cyclohexyl (1E)-N-hydroxyethanimidate.

Molecular Properties

Compound Namecyclohexyl (1E)-N-hydroxyethanimidate
PubChem CID175672760
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Namecyclohexyl (1E)-N-hydroxyethanimidate
SMILESC/C(=N\O)OC1CCCCC1
InChIInChI=1S/C8H15NO2/c1-7(9-10)11-8-5-3-2-4-6-8/h8,10H,2-6H2,1H3/b9-7+
InChIKeyXWDWMOXBUOKLOZ-VQHVLOKHSA-N
XLogP2.14
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', '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

2-Methoxycyclohexan-1-one oxime
CID 21604081
Gqvinghnswasnt-sofgywhqsa-
CID 10820644
N-[4-(2-fluoroethoxy)cyclohexylidene]hydroxylamine
CID 104456308
(NE)-N-[(2R)-2-methoxycyclohexylidene]hydroxylamine
CID 98617104
N-(4-Methoxycyclohexylidene)hydroxylamine
CID 71396464
1-(Hydroxyimino)-2-methoxycyclohexane
CID 73799246
N,4-dimethoxycyclohexan-1-imine
CID 123405438
3-Methyl-4a,5,6,7,8,8a-hexahydro-1,4,2-benzodioxazine
CID 142566165
(NE)-N-[(2S)-2-methyloxan-4-ylidene]hydroxylamine
CID 163402249
hexyl N-hydroxyethanimidate
CID 173451645
(E)-N,2-dimethoxycyclohexan-1-imine
CID 21604089
(Z)-N,2-dimethoxycyclohexan-1-imine
CID 21604090

Frequently Asked Questions

What is the IUPAC name of cyclohexyl (1E)-N-hydroxyethanimidate?
The IUPAC name of cyclohexyl (1E)-N-hydroxyethanimidate (CID 175672760) is cyclohexyl (1E)-N-hydroxyethanimidate.
What is the SMILES notation for cyclohexyl (1E)-N-hydroxyethanimidate?
The canonical SMILES for cyclohexyl (1E)-N-hydroxyethanimidate is C/C(=N\O)OC1CCCCC1.
What is the InChIKey of cyclohexyl (1E)-N-hydroxyethanimidate?
The InChIKey is XWDWMOXBUOKLOZ-VQHVLOKHSA-N. The full InChI is InChI=1S/C8H15NO2/c1-7(9-10)11-8-5-3-2-4-6-8/h8,10H,2-6H2,1H3/b9-7+.
What are the key properties of cyclohexyl (1E)-N-hydroxyethanimidate?
cyclohexyl (1E)-N-hydroxyethanimidate has a molecular weight of 157.21 g/mol, XLogP of 2.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl (1E)-N-hydroxyethanimidate is sourced from PubChem (CID 175672760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).