N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide

C12H24N2O2 — CID 109374692

IUPACN'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide
SMILESCC1CCC(OCCCC/C(N)=N/O)CC1
InChIInChI=1S/C12H24N2O2/c1-10-5-7-11(8-6-10)16-9-3-2-4-12(13)14-15/h10-11,15H,2-9H2,1H3,(H2,13,14)
InChIKeyMVFLLSSGBUVXOC-UHFFFAOYSA-N
MW228.34 g/mol
LogP2.50
Rot. Bonds6

About N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide

N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide (PubChem CID 109374692) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide.

Molecular Properties

Compound NameN'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide
PubChem CID109374692
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide
SMILESCC1CCC(OCCCC/C(N)=N/O)CC1
InChIInChI=1S/C12H24N2O2/c1-10-5-7-11(8-6-10)16-9-3-2-4-12(13)14-15/h10-11,15H,2-9H2,1H3,(H2,13,14)
InChIKeyMVFLLSSGBUVXOC-UHFFFAOYSA-N
XLogP2.50
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 52.50
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': '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

3,3,3-trifluoro-N'-hydroxy-2-[(4-methylcyclohexyl)oxymethyl]propanimidamide
CID 103370342
4-(4-Ethylheptoxy)cyclohexane-1-carboximidamide
CID 89242726
[4-(N'-hydroxycarbamimidoyl)cyclohexyl] carbamate
CID 175101382
N'-hydroxy-2-(4-methylcyclohexyl)oxyethanimidamide
CID 24690918
N'-hydroxy-3-(4-methylcyclohexyl)oxypropanimidamide
CID 24691798
4-(4-Methylcyclohexyl)oxybutanimidamide
CID 24693381
N'-hydroxy-3-(2-methylcyclohexyl)oxypropanimidamide
CID 24693790
3-(2-ethylcyclohexyl)oxy-N'-hydroxypropanimidamide
CID 24702260
N'-hydroxy-4-(4-methylcyclohexyl)oxybutanimidamide
CID 24704176
4-(2-ethylcyclohexyl)oxy-N'-hydroxybutanimidamide
CID 24704430
N'-hydroxy-4-(2-methylcyclohexyl)oxybutanimidamide
CID 24707931
4-(2-ethylhexoxy)-N'-hydroxybutanimidamide
CID 43128388

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide?
The IUPAC name of N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide (CID 109374692) is N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide.
What is the SMILES notation for N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide?
The canonical SMILES for N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide is CC1CCC(OCCCC/C(N)=N/O)CC1.
What is the InChIKey of N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide?
The InChIKey is MVFLLSSGBUVXOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-10-5-7-11(8-6-10)16-9-3-2-4-12(13)14-15/h10-11,15H,2-9H2,1H3,(H2,13,14).
What are the key properties of N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide?
N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide has a molecular weight of 228.34 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-5-(4-methylcyclohexyl)oxypentanimidamide is sourced from PubChem (CID 109374692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).