2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide

C13H16N2O2 — CID 47102090

IUPAC2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide
SMILESCc1ccccc1C(=O)NNC(=O)C1CC1C
InChIInChI=1S/C13H16N2O2/c1-8-5-3-4-6-10(8)12(16)14-15-13(17)11-7-9(11)2/h3-6,9,11H,7H2,1-2H3,(H,14,16)(H,15,17)
InChIKeyFJDIRHQPXUOTQP-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.41
Rot. Bonds2

About 2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide

2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide (PubChem CID 47102090) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide.

Molecular Properties

Compound Name2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide
PubChem CID47102090
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide
SMILESCc1ccccc1C(=O)NNC(=O)C1CC1C
InChIInChI=1S/C13H16N2O2/c1-8-5-3-4-6-10(8)12(16)14-15-13(17)11-7-9(11)2/h3-6,9,11H,7H2,1-2H3,(H,14,16)(H,15,17)
InChIKeyFJDIRHQPXUOTQP-UHFFFAOYSA-N
XLogP1.41
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide?
The IUPAC name of 2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide (CID 47102090) is 2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide.
What is the SMILES notation for 2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide?
The canonical SMILES for 2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide is Cc1ccccc1C(=O)NNC(=O)C1CC1C.
What is the InChIKey of 2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide?
The InChIKey is FJDIRHQPXUOTQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-8-5-3-4-6-10(8)12(16)14-15-13(17)11-7-9(11)2/h3-6,9,11H,7H2,1-2H3,(H,14,16)(H,15,17).
What are the key properties of 2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide?
2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide has a molecular weight of 232.28 g/mol, XLogP of 1.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N'-(2-methylcyclopropanecarbonyl)benzohydrazide is sourced from PubChem (CID 47102090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).