4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide

C24H32N2O3 — CID 54782195

IUPAC4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide
SMILESCC(C)COc1ccc(C(=O)NNC(=O)C(C)c2ccc(CC(C)C)cc2)cc1
InChIInChI=1S/C24H32N2O3/c1-16(2)14-19-6-8-20(9-7-19)18(5)23(27)25-26-24(28)21-10-12-22(13-11-21)29-15-17(3)4/h6-13,16-18H,14-15H2,1-5H3,(H,25,27)(H,26,28)
InChIKeyXSOVTUONNPWMIY-UHFFFAOYSA-N
MW396.53 g/mol
LogP4.48
Rot. Bonds8

About 4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide

4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide (PubChem CID 54782195) has the molecular formula C24H32N2O3 and a molecular weight of 396.53 g/mol. Its IUPAC name is 4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide.

Molecular Properties

Compound Name4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide
PubChem CID54782195
Molecular FormulaC24H32N2O3
Molecular Weight396.53 g/mol
Exact Mass396.24
IUPAC Name4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide
SMILESCC(C)COc1ccc(C(=O)NNC(=O)C(C)c2ccc(CC(C)C)cc2)cc1
InChIInChI=1S/C24H32N2O3/c1-16(2)14-19-6-8-20(9-7-19)18(5)23(27)25-26-24(28)21-10-12-22(13-11-21)29-15-17(3)4/h6-13,16-18H,14-15H2,1-5H3,(H,25,27)(H,26,28)
InChIKeyXSOVTUONNPWMIY-UHFFFAOYSA-N
XLogP4.48
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.53
LogP ≤ 54.48
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'-[2-[4-(2-methylpropyl)phenyl]propanoyl]-4-prop-2-enoxybenzohydrazide
CID 54782181
4-(2-methylpropoxy)-N'-[4-(2-methylpropoxy)benzoyl]benzohydrazide
CID 4937273
N'-[4-(2-methylpropoxy)benzoyl]-4-propan-2-ylbenzohydrazide
CID 17177578
3,4-dimethoxy-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide
CID 54782152
N'-[2-(4-bromophenoxy)acetyl]-2-[4-(2-methylpropyl)phenyl]propanehydrazide
CID 54782165
4-tert-butyl-N'-[4-(2-methylpropoxy)benzoyl]benzohydrazide
CID 4930158
N-[4-[[2-[4-(2-methylpropyl)phenyl]propanoylamino]carbamoyl]phenyl]cyclopropanecarboxamide
CID 54782194
N-[3-(2-methylpropoxy)phenyl]-2-[4-(2-methylpropyl)phenyl]propanamide
CID 54781971
N'-(4-butan-2-yloxybenzoyl)-4-(2-methylpropoxy)benzohydrazide
CID 17141455
N'-[4-(2-methylpropoxy)benzoyl]-4-pentoxybenzohydrazide
CID 4935435
2-methyl-N-[[[4-(2-methylpropoxy)benzoyl]amino]carbamothioyl]propanamide
CID 4930344
2-[4-(2-methylpropyl)phenyl]propanehydrazide
CID 2736674

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide?
The IUPAC name of 4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide (CID 54782195) is 4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide.
What is the SMILES notation for 4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide?
The canonical SMILES for 4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide is CC(C)COc1ccc(C(=O)NNC(=O)C(C)c2ccc(CC(C)C)cc2)cc1.
What is the InChIKey of 4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide?
The InChIKey is XSOVTUONNPWMIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O3/c1-16(2)14-19-6-8-20(9-7-19)18(5)23(27)25-26-24(28)21-10-12-22(13-11-21)29-15-17(3)4/h6-13,16-18H,14-15H2,1-5H3,(H,25,27)(H,26,28).
What are the key properties of 4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide?
4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide has a molecular weight of 396.53 g/mol, XLogP of 4.48, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpropoxy)-N'-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzohydrazide is sourced from PubChem (CID 54782195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).