2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide

C14H16N2O3 — CID 63569299

IUPAC2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide
SMILESNNC(=O)c1c(COC2CCC2)oc2ccccc12
InChIInChI=1S/C14H16N2O3/c15-16-14(17)13-10-6-1-2-7-11(10)19-12(13)8-18-9-4-3-5-9/h1-2,6-7,9H,3-5,8,15H2,(H,16,17)
InChIKeyCUGURTSEZCNCIG-UHFFFAOYSA-N
MW260.29 g/mol
LogP2.11
Rot. Bonds4

About 2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide

2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide (PubChem CID 63569299) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide.

Molecular Properties

Compound Name2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide
PubChem CID63569299
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide
SMILESNNC(=O)c1c(COC2CCC2)oc2ccccc12
InChIInChI=1S/C14H16N2O3/c15-16-14(17)13-10-6-1-2-7-11(10)19-12(13)8-18-9-4-3-5-9/h1-2,6-7,9H,3-5,8,15H2,(H,16,17)
InChIKeyCUGURTSEZCNCIG-UHFFFAOYSA-N
XLogP2.11
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 52.11
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'}

Analyze 2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(oxolan-2-ylmethoxymethyl)-1-benzofuran-3-carbohydrazide
CID 63575257
2-(ethoxymethyl)-1-benzofuran-3-carbohydrazide
CID 55213785
2-(pyrrolidin-1-ylmethyl)-1-benzofuran-3-carbohydrazide
CID 55212248
2-(piperidin-1-ylmethyl)-1-benzofuran-3-carbohydrazide
CID 63569906
2-[(3-methoxypyrrolidin-1-yl)methyl]-1-benzofuran-3-carbohydrazide
CID 103540522
2-[(2-methylpiperidin-1-yl)methyl]-1-benzofuran-3-carbohydrazide
CID 63570845
2-[(3-hydroxypiperidin-1-yl)methyl]-1-benzofuran-3-carbohydrazide
CID 63585728
2-[[cyclopropylmethyl(ethyl)amino]methyl]-1-benzofuran-3-carbohydrazide
CID 63938947
2-[(1-methylpyrazol-4-yl)oxymethyl]-1-benzofuran-3-carbohydrazide
CID 116793806
1-[2-(cyclopentyloxymethyl)-1-benzofuran-3-yl]-N-methylmethanamine
CID 62444638
N-[[2-(cyclohexyloxymethyl)-1-benzofuran-3-yl]methyl]ethanamine
CID 62446327
2-[(3-methylpyrrolidin-1-yl)methyl]-1-benzofuran-3-carbohydrazide
CID 63573029

Frequently Asked Questions

What is the IUPAC name of 2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide?
The IUPAC name of 2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide (CID 63569299) is 2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide.
What is the SMILES notation for 2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide?
The canonical SMILES for 2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide is NNC(=O)c1c(COC2CCC2)oc2ccccc12.
What is the InChIKey of 2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide?
The InChIKey is CUGURTSEZCNCIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c15-16-14(17)13-10-6-1-2-7-11(10)19-12(13)8-18-9-4-3-5-9/h1-2,6-7,9H,3-5,8,15H2,(H,16,17).
What are the key properties of 2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide?
2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide has a molecular weight of 260.29 g/mol, XLogP of 2.11, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclobutyloxymethyl)-1-benzofuran-3-carbohydrazide is sourced from PubChem (CID 63569299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).