4-hydroxyiminocyclohexan-1-ol

C6H11NO2 — CID 24822208

IUPAC4-hydroxyiminocyclohexan-1-ol
SMILESON=C1CCC(O)CC1
InChIInChI=1S/C6H11NO2/c8-6-3-1-5(7-9)2-4-6/h6,8-9H,1-4H2/b7-5-
InChIKeyNGKHDRILERUGRD-ALCCZGGFSA-N
MW129.16 g/mol
LogP0.75
Rot. Bonds

About 4-hydroxyiminocyclohexan-1-ol

4-hydroxyiminocyclohexan-1-ol (PubChem CID 24822208) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is 4-hydroxyiminocyclohexan-1-ol.

Molecular Properties

Compound Name4-hydroxyiminocyclohexan-1-ol
PubChem CID24822208
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC Name4-hydroxyiminocyclohexan-1-ol
SMILESON=C1CCC(O)CC1
InChIInChI=1S/C6H11NO2/c8-6-3-1-5(7-9)2-4-6/h6,8-9H,1-4H2/b7-5-
InChIKeyNGKHDRILERUGRD-ALCCZGGFSA-N
XLogP0.75
TPSA52.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 50.75
H-Bond Donors ≤ 52
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

2-Iminocyclohexanol
CID 21113633
2-Methoxycyclohexan-1-one oxime
CID 21604081
2-Hydroxycyclo-hexanone oxime
CID 85385288
Gqvinghnswasnt-sofgywhqsa-
CID 10820644
(2R,4Z,6S)-(2R,4E,6S)-4-(Hydroxyimino)heptan-2,6-diol
CID 129643956
(NE)-N-[(2R)-2-methoxycyclohexylidene]hydroxylamine
CID 98617104
(3-Ethyl-4,5-dihydro-1,2-oxazol-5-yl)methanol
CID 14143956
4-Methoxyiminocyclohexan-1-ol
CID 21134182
(4E)-4-hydroxyiminohexan-3-ol
CID 22415949
4-Iminocyclohexan-1-ol
CID 59686949
N-(4-Methoxycyclohexylidene)hydroxylamine
CID 71396464
1-(Hydroxyimino)-2-methoxycyclohexane
CID 73799246

Frequently Asked Questions

What is the IUPAC name of 4-hydroxyiminocyclohexan-1-ol?
The IUPAC name of 4-hydroxyiminocyclohexan-1-ol (CID 24822208) is 4-hydroxyiminocyclohexan-1-ol.
What is the SMILES notation for 4-hydroxyiminocyclohexan-1-ol?
The canonical SMILES for 4-hydroxyiminocyclohexan-1-ol is ON=C1CCC(O)CC1.
What is the InChIKey of 4-hydroxyiminocyclohexan-1-ol?
The InChIKey is NGKHDRILERUGRD-ALCCZGGFSA-N. The full InChI is InChI=1S/C6H11NO2/c8-6-3-1-5(7-9)2-4-6/h6,8-9H,1-4H2/b7-5-.
What are the key properties of 4-hydroxyiminocyclohexan-1-ol?
4-hydroxyiminocyclohexan-1-ol has a molecular weight of 129.16 g/mol, XLogP of 0.75, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxyiminocyclohexan-1-ol is sourced from PubChem (CID 24822208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).