5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide

C14H22N2O3 — CID 55214949

IUPAC5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide
SMILESCCC1CCCCC1OCc1cc(C(=O)NN)co1
InChIInChI=1S/C14H22N2O3/c1-2-10-5-3-4-6-13(10)19-9-12-7-11(8-18-12)14(17)16-15/h7-8,10,13H,2-6,9,15H2,1H3,(H,16,17)
InChIKeyNDXZHZWFEWXBPC-UHFFFAOYSA-N
MW266.34 g/mol
LogP2.37
Rot. Bonds5

About 5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide

5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide (PubChem CID 55214949) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide.

Molecular Properties

Compound Name5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide
PubChem CID55214949
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide
SMILESCCC1CCCCC1OCc1cc(C(=O)NN)co1
InChIInChI=1S/C14H22N2O3/c1-2-10-5-3-4-6-13(10)19-9-12-7-11(8-18-12)14(17)16-15/h7-8,10,13H,2-6,9,15H2,1H3,(H,16,17)
InChIKeyNDXZHZWFEWXBPC-UHFFFAOYSA-N
XLogP2.37
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 52.37
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-ethylcyclohexyl)oxymethyl]furan-2-carbohydrazide
CID 63576626
1-[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]-N-methylmethanamine
CID 62445491
N-[[5-[(2-ethylcyclohexyl)oxymethyl]furan-3-yl]methyl]cyclopropanamine
CID 62445685
5-[(4-ethylpiperidin-1-yl)methyl]furan-3-carbohydrazide
CID 63578224
5-(propan-2-yloxymethyl)furan-3-carbohydrazide
CID 63574391
6-[(2-ethylcyclohexyl)oxymethyl]pyridine-2-carbohydrazide
CID 106908788
5-(cyclohexylsulfanylmethyl)furan-3-carbohydrazide
CID 55215056
N-[[5-[(2-ethylcyclohexyl)oxymethyl]-2-methylfuran-3-yl]methyl]ethanamine
CID 62445490
4-[(2-ethylcyclohexyl)oxymethyl]-5-methylfuran-2-carboxylic acid
CID 62274302
5-[(2-methylpyrrolidin-1-yl)methyl]furan-3-carbohydrazide
CID 63570944
[4-[(2-ethylcyclohexyl)oxymethyl]-5-methylfuran-2-yl]methanamine
CID 62445112
5-[(2-ethylcyclohexyl)oxymethyl]-2-fluorobenzoic acid
CID 107881104

Frequently Asked Questions

What is the IUPAC name of 5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide?
The IUPAC name of 5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide (CID 55214949) is 5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide.
What is the SMILES notation for 5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide?
The canonical SMILES for 5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide is CCC1CCCCC1OCc1cc(C(=O)NN)co1.
What is the InChIKey of 5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide?
The InChIKey is NDXZHZWFEWXBPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-2-10-5-3-4-6-13(10)19-9-12-7-11(8-18-12)14(17)16-15/h7-8,10,13H,2-6,9,15H2,1H3,(H,16,17).
What are the key properties of 5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide?
5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide has a molecular weight of 266.34 g/mol, XLogP of 2.37, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-ethylcyclohexyl)oxymethyl]furan-3-carbohydrazide is sourced from PubChem (CID 55214949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).