2-(cyclohexyloxymethyl)furan-3-carbohydrazide

C12H18N2O3 — CID 63588139

IUPAC2-(cyclohexyloxymethyl)furan-3-carbohydrazide
SMILESNNC(=O)c1ccoc1COC1CCCCC1
InChIInChI=1S/C12H18N2O3/c13-14-12(15)10-6-7-16-11(10)8-17-9-4-2-1-3-5-9/h6-7,9H,1-5,8,13H2,(H,14,15)
InChIKeyIZZZCQSVCAPNGP-UHFFFAOYSA-N
MW238.29 g/mol
LogP1.73
Rot. Bonds4

About 2-(cyclohexyloxymethyl)furan-3-carbohydrazide

2-(cyclohexyloxymethyl)furan-3-carbohydrazide (PubChem CID 63588139) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-(cyclohexyloxymethyl)furan-3-carbohydrazide.

Molecular Properties

Compound Name2-(cyclohexyloxymethyl)furan-3-carbohydrazide
PubChem CID63588139
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name2-(cyclohexyloxymethyl)furan-3-carbohydrazide
SMILESNNC(=O)c1ccoc1COC1CCCCC1
InChIInChI=1S/C12H18N2O3/c13-14-12(15)10-6-7-16-11(10)8-17-9-4-2-1-3-5-9/h6-7,9H,1-5,8,13H2,(H,14,15)
InChIKeyIZZZCQSVCAPNGP-UHFFFAOYSA-N
XLogP1.73
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[(3,4-dimethylcyclohexyl)oxymethyl]furan-3-carbohydrazide
CID 64740338
2-(cyclohexylmethoxymethyl)furan-3-carbohydrazide
CID 63569313
2-[(4-ethoxypiperidin-1-yl)methyl]furan-3-carbohydrazide
CID 63572841
2-(octoxymethyl)furan-3-carbohydrazide
CID 63574840
2-(cyclobutyloxymethyl)benzohydrazide
CID 63568933
2-[2-(2-methoxyethoxy)ethoxymethyl]furan-3-carbohydrazide
CID 104567494
2-(4,4,4-trifluorobutoxymethyl)furan-3-carbohydrazide
CID 82793157
3-(cyclohexyloxymethyl)furan-2-carboxylic acid
CID 43153123
5-(cyclobutyloxymethyl)furan-2-carbohydrazide
CID 63568578
2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide
CID 63569299
2-[(3-aminopiperidin-1-yl)methyl]furan-3-carbohydrazide
CID 63583479
2-(2-cycloheptyloxyethoxy)benzohydrazide
CID 63570919

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexyloxymethyl)furan-3-carbohydrazide?
The IUPAC name of 2-(cyclohexyloxymethyl)furan-3-carbohydrazide (CID 63588139) is 2-(cyclohexyloxymethyl)furan-3-carbohydrazide.
What is the SMILES notation for 2-(cyclohexyloxymethyl)furan-3-carbohydrazide?
The canonical SMILES for 2-(cyclohexyloxymethyl)furan-3-carbohydrazide is NNC(=O)c1ccoc1COC1CCCCC1.
What is the InChIKey of 2-(cyclohexyloxymethyl)furan-3-carbohydrazide?
The InChIKey is IZZZCQSVCAPNGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c13-14-12(15)10-6-7-16-11(10)8-17-9-4-2-1-3-5-9/h6-7,9H,1-5,8,13H2,(H,14,15).
What are the key properties of 2-(cyclohexyloxymethyl)furan-3-carbohydrazide?
2-(cyclohexyloxymethyl)furan-3-carbohydrazide has a molecular weight of 238.29 g/mol, XLogP of 1.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexyloxymethyl)furan-3-carbohydrazide is sourced from PubChem (CID 63588139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).