(2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol

C15H29NO2 — CID 88802914

IUPAC(2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol
SMILESCCCCCCCCCC1CCC(O)/C(=N\O)C1
InChIInChI=1S/C15H29NO2/c1-2-3-4-5-6-7-8-9-13-10-11-15(17)14(12-13)16-18/h13,15,17-18H,2-12H2,1H3/b16-14-
InChIKeyZEKOJPHLVZTXPK-PEZBUJJGSA-N
MW255.40 g/mol
LogP4.12
Rot. Bonds8

About (2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol

(2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol (PubChem CID 88802914) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is (2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol.

Molecular Properties

Compound Name(2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol
PubChem CID88802914
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name(2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol
SMILESCCCCCCCCCC1CCC(O)/C(=N\O)C1
InChIInChI=1S/C15H29NO2/c1-2-3-4-5-6-7-8-9-13-10-11-15(17)14(12-13)16-18/h13,15,17-18H,2-12H2,1H3/b16-14-
InChIKeyZEKOJPHLVZTXPK-PEZBUJJGSA-N
XLogP4.12
TPSA52.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
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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Frequently Asked Questions

What is the IUPAC name of (2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol?
The IUPAC name of (2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol (CID 88802914) is (2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol.
What is the SMILES notation for (2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol?
The canonical SMILES for (2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol is CCCCCCCCCC1CCC(O)/C(=N\O)C1.
What is the InChIKey of (2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol?
The InChIKey is ZEKOJPHLVZTXPK-PEZBUJJGSA-N. The full InChI is InChI=1S/C15H29NO2/c1-2-3-4-5-6-7-8-9-13-10-11-15(17)14(12-13)16-18/h13,15,17-18H,2-12H2,1H3/b16-14-.
What are the key properties of (2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol?
(2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol has a molecular weight of 255.40 g/mol, XLogP of 4.12, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-hydroxyimino-4-nonylcyclohexan-1-ol is sourced from PubChem (CID 88802914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).