4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide

C16H18N2O3 — CID 63575043

IUPAC4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide
SMILESCc1oc(C(=O)NN)cc1COc1ccc2c(c1)CCC2
InChIInChI=1S/C16H18N2O3/c1-10-13(8-15(21-10)16(19)18-17)9-20-14-6-5-11-3-2-4-12(11)7-14/h5-8H,2-4,9,17H2,1H3,(H,18,19)
InChIKeyZIGVFHRFVSVHFS-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.26
Rot. Bonds4

About 4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide

4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide (PubChem CID 63575043) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide.

Molecular Properties

Compound Name4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide
PubChem CID63575043
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide
SMILESCc1oc(C(=O)NN)cc1COc1ccc2c(c1)CCC2
InChIInChI=1S/C16H18N2O3/c1-10-13(8-15(21-10)16(19)18-17)9-20-14-6-5-11-3-2-4-12(11)7-14/h5-8H,2-4,9,17H2,1H3,(H,18,19)
InChIKeyZIGVFHRFVSVHFS-UHFFFAOYSA-N
XLogP2.26
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.26
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

5-(2,3-dihydro-1H-inden-5-yloxymethyl)-3-methylfuran-2-carbohydrazide
CID 63574877
4-[(3-ethylphenoxy)methyl]-5-methylfuran-2-carbohydrazide
CID 63576037
4-[(3-chloro-4-cyanophenoxy)methyl]-5-methylfuran-2-carbohydrazide
CID 102724819
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-[(4-methylphenyl)methoxy]furan-2-carboxamide
CID 3461178
4-(hydroxymethyl)-5-methylfuran-2-carbohydrazide
CID 63576410
4-[(4-chlorophenyl)methoxymethyl]-5-methylfuran-2-carbohydrazide
CID 65130569
ethyl 2-[2-[[5-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-2-carbonyl]amino]-1,3-thiazol-4-yl]acetate
CID 19458910
5-methyl-4-[(2-nitrophenoxy)methyl]furan-2-carbohydrazide
CID 63574456
N-cycloheptyl-5-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-2-carboxamide
CID 19458831
4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methyl-1,2-oxazole-3-carboxylic acid
CID 19623168
4-[(3-methoxyphenyl)methoxymethyl]-5-methylfuran-2-carbohydrazide
CID 63587965
methyl 2-(2,3-dihydro-1H-inden-5-yloxy)acetate
CID 43082820

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide?
The IUPAC name of 4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide (CID 63575043) is 4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide.
What is the SMILES notation for 4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide?
The canonical SMILES for 4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide is Cc1oc(C(=O)NN)cc1COc1ccc2c(c1)CCC2.
What is the InChIKey of 4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide?
The InChIKey is ZIGVFHRFVSVHFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-10-13(8-15(21-10)16(19)18-17)9-20-14-6-5-11-3-2-4-12(11)7-14/h5-8H,2-4,9,17H2,1H3,(H,18,19).
What are the key properties of 4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide?
4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide has a molecular weight of 286.33 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1H-inden-5-yloxymethyl)-5-methylfuran-2-carbohydrazide is sourced from PubChem (CID 63575043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).