2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide

C16H18N2O4 — CID 46480731

IUPAC2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide
SMILESCc1occc1C(=O)NNC(=O)C(C)OCc1ccccc1
InChIInChI=1S/C16H18N2O4/c1-11-14(8-9-21-11)16(20)18-17-15(19)12(2)22-10-13-6-4-3-5-7-13/h3-9,12H,10H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyKXVRDCUXKMZKQM-UHFFFAOYSA-N
MW302.33 g/mol
LogP1.95
Rot. Bonds5

About 2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide

2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide (PubChem CID 46480731) has the molecular formula C16H18N2O4 and a molecular weight of 302.33 g/mol. Its IUPAC name is 2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide.

Molecular Properties

Compound Name2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide
PubChem CID46480731
Molecular FormulaC16H18N2O4
Molecular Weight302.33 g/mol
Exact Mass302.13
IUPAC Name2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide
SMILESCc1occc1C(=O)NNC(=O)C(C)OCc1ccccc1
InChIInChI=1S/C16H18N2O4/c1-11-14(8-9-21-11)16(20)18-17-15(19)12(2)22-10-13-6-4-3-5-7-13/h3-9,12H,10H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyKXVRDCUXKMZKQM-UHFFFAOYSA-N
XLogP1.95
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-methyl-N'-(2-phenylmethoxypropanoyl)furan-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

2,5-dichloro-N'-(2-phenylmethoxypropanoyl)benzohydrazide
CID 86983287
2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide
CID 43042434
N-[(2S)-1-[2-(2-methylfuran-3-carbonyl)hydrazinyl]-1-oxo-3-phenylpropan-2-yl]benzamide
CID 7601258
1-methyl-3-(2-phenylmethoxypropanoylamino)urea
CID 47383903
2-methyl-N'-[2-(3-methylphenoxy)propanoyl]furan-3-carbohydrazide
CID 18104346
N'-(3-methoxy-4-phenylmethoxybenzoyl)-2-methylfuran-3-carbohydrazide
CID 9472683
[(2S)-1-(benzylamino)-1-oxopropan-2-yl] 2-methylfuran-3-carboxylate
CID 7663588
2-methyl-N'-[(2S)-2-(3-methyl-4-propan-2-ylphenoxy)propanoyl]furan-3-carbohydrazide
CID 51958181
3-methyl-2-(2-phenylmethoxypropanoylamino)butanoic acid
CID 43354070
N'-[2-(2,3-dimethylphenoxy)propanoyl]-2-phenylmethoxypropanehydrazide
CID 55650544
(2S)-2-[[(2S)-2-phenylmethoxypropanoyl]amino]propanoic acid
CID 10777126
2-methyl-N'-(4-methylpentanoyl)furan-3-carbohydrazide
CID 31287028

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide?
The IUPAC name of 2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide (CID 46480731) is 2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide.
What is the SMILES notation for 2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide?
The canonical SMILES for 2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide is Cc1occc1C(=O)NNC(=O)C(C)OCc1ccccc1.
What is the InChIKey of 2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide?
The InChIKey is KXVRDCUXKMZKQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4/c1-11-14(8-9-21-11)16(20)18-17-15(19)12(2)22-10-13-6-4-3-5-7-13/h3-9,12H,10H2,1-2H3,(H,17,19)(H,18,20).
What are the key properties of 2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide?
2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide has a molecular weight of 302.33 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide is sourced from PubChem (CID 46480731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).