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

C11H16N2O3 — CID 43042434

IUPAC2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide
SMILESCCC(C)C(=O)NNC(=O)c1ccoc1C
InChIInChI=1S/C11H16N2O3/c1-4-7(2)10(14)12-13-11(15)9-5-6-16-8(9)3/h5-7H,4H2,1-3H3,(H,12,14)(H,13,15)
InChIKeyPSRFEMXDWFHPFQ-UHFFFAOYSA-N
MW224.26 g/mol
LogP1.40
Rot. Bonds3

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

2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide (PubChem CID 43042434) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide.

Molecular Properties

Compound Name2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide
PubChem CID43042434
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide
SMILESCCC(C)C(=O)NNC(=O)c1ccoc1C
InChIInChI=1S/C11H16N2O3/c1-4-7(2)10(14)12-13-11(15)9-5-6-16-8(9)3/h5-7H,4H2,1-3H3,(H,12,14)(H,13,15)
InChIKeyPSRFEMXDWFHPFQ-UHFFFAOYSA-N
XLogP1.40
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(2S)-butan-2-yl]-2-methylfuran-3-carboxamide
CID 40584922
2-methyl-N'-(4-methylpentanoyl)furan-3-carbohydrazide
CID 31287028
1-N',4-N'-bis(2-methylfuran-3-carbonyl)benzene-1,4-dicarbohydrazide
CID 1011836
2-methyl-N'-(2-phenylmethoxypropanoyl)furan-3-carbohydrazide
CID 46480731
N'-[(2R)-2-(4-chlorophenyl)-3-methylbutanoyl]-2-methylfuran-3-carbohydrazide
CID 7809092
N-[(2S)-1-[2-(2-methylfuran-3-carbonyl)hydrazinyl]-1-oxo-3-phenylpropan-2-yl]benzamide
CID 7601258
1-[(2-methylfuran-3-carbonyl)amino]-3-(4-phenylbutan-2-yl)urea
CID 42952795
2-methyl-N'-[2-(3-methylphenoxy)propanoyl]furan-3-carbohydrazide
CID 18104346
2-[(2-methylfuran-3-carbonyl)amino]propanoic acid
CID 16774723
2-methyl-N'-[(2S)-2-(3-methyl-4-propan-2-ylphenoxy)propanoyl]furan-3-carbohydrazide
CID 51958181
2-methyl-N-(2-methylpropoxy)furan-3-carboxamide
CID 115409998
3-methoxy-2-[(2-methylfuran-3-carbonyl)amino]propanoic acid
CID 81077472

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide?
The IUPAC name of 2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide (CID 43042434) is 2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide.
What is the SMILES notation for 2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide?
The canonical SMILES for 2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide is CCC(C)C(=O)NNC(=O)c1ccoc1C.
What is the InChIKey of 2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide?
The InChIKey is PSRFEMXDWFHPFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-4-7(2)10(14)12-13-11(15)9-5-6-16-8(9)3/h5-7H,4H2,1-3H3,(H,12,14)(H,13,15).
What are the key properties of 2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide?
2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide has a molecular weight of 224.26 g/mol, XLogP of 1.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N'-(2-methylbutanoyl)furan-3-carbohydrazide is sourced from PubChem (CID 43042434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).