2-methyl-N'-phenylprop-2-enehydrazide

C10H12N2O — CID 2303225

IUPAC2-methyl-N'-phenylprop-2-enehydrazide
SMILESC=C(C)C(=O)NNc1ccccc1
InChIInChI=1S/C10H12N2O/c1-8(2)10(13)12-11-9-6-4-3-5-7-9/h3-7,11H,1H2,2H3,(H,12,13)
InChIKeyLCDPUQDXKZMQKQ-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.71
Rot. Bonds3

About 2-methyl-N'-phenylprop-2-enehydrazide

2-methyl-N'-phenylprop-2-enehydrazide (PubChem CID 2303225) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 2-methyl-N'-phenylprop-2-enehydrazide.

Molecular Properties

Compound Name2-methyl-N'-phenylprop-2-enehydrazide
PubChem CID2303225
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name2-methyl-N'-phenylprop-2-enehydrazide
SMILESC=C(C)C(=O)NNc1ccccc1
InChIInChI=1S/C10H12N2O/c1-8(2)10(13)12-11-9-6-4-3-5-7-9/h3-7,11H,1H2,2H3,(H,12,13)
InChIKeyLCDPUQDXKZMQKQ-UHFFFAOYSA-N
XLogP1.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Phenicarbazide
CID 61002
Acetylphenylhydrazine
CID 8247
N'(1),N'(2)-Diphenylethanedihydrazide
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2,2,2-trifluoro-N'-phenylacetohydrazide
CID 36669
Propionic acid phenylhydrazide
CID 88671
2-Acetyl-2-methyl-1-phenylhydrazine
CID 93206
N'-(2-fluorophenyl)cyclobutanecarbohydrazide
CID 2812151
4-Phenylhydrazono-3-methyl-2-pyrazolin-5-one
CID 318025
N-(4-Bromophenyl)propanehydrazonic acid
CID 769159
4-methyl-N'-(2-methylphenyl)pentanehydrazide
CID 11955729
N'-(2-methylphenyl)heptanehydrazide
CID 11955771
N'-(3-methylphenyl)cyclobutanecarbohydrazide
CID 2812381

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N'-phenylprop-2-enehydrazide?
The IUPAC name of 2-methyl-N'-phenylprop-2-enehydrazide (CID 2303225) is 2-methyl-N'-phenylprop-2-enehydrazide.
What is the SMILES notation for 2-methyl-N'-phenylprop-2-enehydrazide?
The canonical SMILES for 2-methyl-N'-phenylprop-2-enehydrazide is C=C(C)C(=O)NNc1ccccc1.
What is the InChIKey of 2-methyl-N'-phenylprop-2-enehydrazide?
The InChIKey is LCDPUQDXKZMQKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-8(2)10(13)12-11-9-6-4-3-5-7-9/h3-7,11H,1H2,2H3,(H,12,13).
What are the key properties of 2-methyl-N'-phenylprop-2-enehydrazide?
2-methyl-N'-phenylprop-2-enehydrazide has a molecular weight of 176.22 g/mol, XLogP of 1.71, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N'-phenylprop-2-enehydrazide is sourced from PubChem (CID 2303225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).