2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide

C9H19N3O — CID 24706703

IUPAC2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide
SMILESCN(C/C(N)=N/O)C1CCCCC1
InChIInChI=1S/C9H19N3O/c1-12(7-9(10)11-13)8-5-3-2-4-6-8/h8,13H,2-7H2,1H3,(H2,10,11)
InChIKeyBSCIFCQZBDVRLC-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.00
Rot. Bonds3

About 2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide

2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide (PubChem CID 24706703) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide
PubChem CID24706703
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide
SMILESCN(C/C(N)=N/O)C1CCCCC1
InChIInChI=1S/C9H19N3O/c1-12(7-9(10)11-13)8-5-3-2-4-6-8/h8,13H,2-7H2,1H3,(H2,10,11)
InChIKeyBSCIFCQZBDVRLC-UHFFFAOYSA-N
XLogP1.00
TPSA61.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
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': '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

5-[cyclohexyl(methyl)amino]-N'-hydroxypentanimidamide
CID 109374536
2-[cyclohexyl(methyl)amino]acetamide
CID 22200523
N'-hydroxy-2-[(2-hydroxycyclohexyl)-methylamino]ethanimidamide
CID 102632406
N'-hydroxy-2-[methyl-(2-methylcyclohexyl)amino]ethanimidamide
CID 76912047
2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide
CID 77037907
2-[(3,4-dimethylcyclohexyl)-methylamino]-N'-hydroxyethanimidamide
CID 77054342
N-(2-amino-2-hydroxyiminoethyl)-N-cyclopentylcyclooctanecarboxamide
CID 77052784
5-[3-[cyclohexyl(methyl)amino]propylamino]-N'-hydroxypentanimidamide
CID 77029969
2-[cyclopentyl(cyclopentylmethyl)amino]-N'-hydroxyethanimidamide
CID 77044633
N-(2-amino-2-hydroxyiminoethyl)-N-cyclopentyl-2-methylpropanamide
CID 77044650
3-[cyclobutyl(methyl)amino]-N'-hydroxybutanimidamide
CID 104873509
2-[cyclopentyl-[methyl(propan-2-yl)sulfamoyl]amino]-N'-hydroxyethanimidamide
CID 77038132

Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide?
The IUPAC name of 2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide (CID 24706703) is 2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide?
The canonical SMILES for 2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide is CN(C/C(N)=N/O)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide?
The InChIKey is BSCIFCQZBDVRLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-12(7-9(10)11-13)8-5-3-2-4-6-8/h8,13H,2-7H2,1H3,(H2,10,11).
What are the key properties of 2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide?
2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide has a molecular weight of 185.27 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide is sourced from PubChem (CID 24706703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).