N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide

C15H19N3O2 — CID 62248634

IUPACN-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide
SMILESCc1cc(C(C)NC(=O)c2ccc(NN)cc2)c(C)o1
InChIInChI=1S/C15H19N3O2/c1-9-8-14(11(3)20-9)10(2)17-15(19)12-4-6-13(18-16)7-5-12/h4-8,10,18H,16H2,1-3H3,(H,17,19)
InChIKeyIGDIENDYWUYWGH-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.67
Rot. Bonds4

About N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide

N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide (PubChem CID 62248634) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide.

Molecular Properties

Compound NameN-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide
PubChem CID62248634
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide
SMILESCc1cc(C(C)NC(=O)c2ccc(NN)cc2)c(C)o1
InChIInChI=1S/C15H19N3O2/c1-9-8-14(11(3)20-9)10(2)17-15(19)12-4-6-13(18-16)7-5-12/h4-8,10,18H,16H2,1-3H3,(H,17,19)
InChIKeyIGDIENDYWUYWGH-UHFFFAOYSA-N
XLogP2.67
TPSA80.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide 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

4-[[(1R)-1-(2,5-dimethylfuran-3-yl)ethyl]carbamoylamino]-N-methylbenzamide
CID 95118026
2-chloro-N-[1-(2,5-dimethylfuran-3-yl)ethyl]pyridine-4-carboxamide
CID 47443000
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-5-hydroxypyridine-3-carboxamide
CID 55257306
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-(methylamino)pyridine-4-carboxamide
CID 62175393
5-bromo-N-[1-(2,5-dimethylfuran-3-yl)ethyl]furan-2-carboxamide
CID 47442995
3-bromo-5-chloro-N-[1-(2,5-dimethylfuran-3-yl)ethyl]benzamide
CID 107952277
4-hydrazinyl-N-(1-phenylethyl)benzamide
CID 62248478
4-[1-(2,5-dimethylfuran-3-yl)ethylamino]-N,N-dimethylbenzamide
CID 43682035
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-2-iodobenzamide
CID 47442999
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-3-hydroxy-2-methylbenzamide
CID 82829104
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-5-(ethylamino)pyridine-2-carboxamide
CID 104640844
2,5-dibromo-N-[1-(2,5-dimethylfuran-3-yl)ethyl]benzamide
CID 114372113

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide?
The IUPAC name of N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide (CID 62248634) is N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide.
What is the SMILES notation for N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide?
The canonical SMILES for N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide is Cc1cc(C(C)NC(=O)c2ccc(NN)cc2)c(C)o1.
What is the InChIKey of N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide?
The InChIKey is IGDIENDYWUYWGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-9-8-14(11(3)20-9)10(2)17-15(19)12-4-6-13(18-16)7-5-12/h4-8,10,18H,16H2,1-3H3,(H,17,19).
What are the key properties of N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide?
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide has a molecular weight of 273.34 g/mol, XLogP of 2.67, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-hydrazinylbenzamide is sourced from PubChem (CID 62248634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).