(3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol

C7H13NO2 — CID 134996633

IUPAC(3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol
SMILESCC1/C(=N\O)CCCC1O
InChIInChI=1S/C7H13NO2/c1-5-6(8-10)3-2-4-7(5)9/h5,7,9-10H,2-4H2,1H3/b8-6-
InChIKeyYCOAARAGGAVYIZ-VURMDHGXSA-N
MW143.19 g/mol
LogP1.00
Rot. Bonds

About (3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol

(3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol (PubChem CID 134996633) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is (3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol.

Molecular Properties

Compound Name(3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol
PubChem CID134996633
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name(3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol
SMILESCC1/C(=N\O)CCCC1O
InChIInChI=1S/C7H13NO2/c1-5-6(8-10)3-2-4-7(5)9/h5,7,9-10H,2-4H2,1H3/b8-6-
InChIKeyYCOAARAGGAVYIZ-VURMDHGXSA-N
XLogP1.00
TPSA52.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 51.00
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

(3Z)-2-butyl-3-hydroxyiminocyclohexan-1-ol
CID 134992670
1-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]cyclohexyl]ethanol
CID 133615818
trans-(1R,3S,5Z)-5-methoxyimino-4-methylcyclohexane-1,3-diol
CID 21308558
2-Hydroxyimino-5-pentylcyclohexan-1-ol
CID 85874775
trans-(1R,3S,5E)-5-methoxyimino-4-methylcyclohexane-1,3-diol
CID 88304091
trans-(1R,3S,5Z)-5-hydroxyimino-4-methylcyclohexane-1,3-diol
CID 88304155
trans-(1R,3S,5E)-5-hydroxyimino-4-methylcyclohexane-1,3-diol
CID 88304156
cis-(1S,3S,5Z)-5-methoxyimino-4-methylcyclohexane-1,3-diol
CID 88304176
cis-(1S,3S,5E)-5-methoxyimino-4-methylcyclohexane-1,3-diol
CID 88304646
cis-(1S,3S,5Z)-5-hydroxyimino-4-methylcyclohexane-1,3-diol
CID 88304904
cis-(1S,3S,5E)-5-hydroxyimino-4-methylcyclohexane-1,3-diol
CID 88304986
(2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol
CID 88802914

Frequently Asked Questions

What is the IUPAC name of (3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol?
The IUPAC name of (3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol (CID 134996633) is (3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol.
What is the SMILES notation for (3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol?
The canonical SMILES for (3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol is CC1/C(=N\O)CCCC1O.
What is the InChIKey of (3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol?
The InChIKey is YCOAARAGGAVYIZ-VURMDHGXSA-N. The full InChI is InChI=1S/C7H13NO2/c1-5-6(8-10)3-2-4-7(5)9/h5,7,9-10H,2-4H2,1H3/b8-6-.
What are the key properties of (3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol?
(3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol has a molecular weight of 143.19 g/mol, XLogP of 1.00, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-hydroxyimino-2-methylcyclohexan-1-ol is sourced from PubChem (CID 134996633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).