N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide

C19H22N2O4 — CID 17496431

IUPACN'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide
SMILESCC(C)Oc1ccc(C(=O)NNC(=O)CCc2ccccc2O)cc1
InChIInChI=1S/C19H22N2O4/c1-13(2)25-16-10-7-15(8-11-16)19(24)21-20-18(23)12-9-14-5-3-4-6-17(14)22/h3-8,10-11,13,22H,9,12H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyRNBSEQOIMXKMNB-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.57
Rot. Bonds6

About N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide

N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide (PubChem CID 17496431) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide.

Molecular Properties

Compound NameN'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide
PubChem CID17496431
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide
SMILESCC(C)Oc1ccc(C(=O)NNC(=O)CCc2ccccc2O)cc1
InChIInChI=1S/C19H22N2O4/c1-13(2)25-16-10-7-15(8-11-16)19(24)21-20-18(23)12-9-14-5-3-4-6-17(14)22/h3-8,10-11,13,22H,9,12H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyRNBSEQOIMXKMNB-UHFFFAOYSA-N
XLogP2.57
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-butanoyl-4-propan-2-yloxybenzohydrazide
CID 17340325
N-[2-oxo-2-[2-(4-propan-2-yloxybenzoyl)hydrazinyl]ethyl]benzamide
CID 43002548
N-[3-oxo-3-[2-(4-propan-2-yloxybenzoyl)hydrazinyl]propyl]acetamide
CID 4789042
N'-[3-(2,5-dioxopyrrolidin-1-yl)propanoyl]-4-propan-2-yloxybenzohydrazide
CID 18279573
N'-(2-naphthalen-2-yloxyacetyl)-4-propan-2-yloxybenzohydrazide
CID 4952087
2-bromo-N-[3-oxo-3-[2-(4-propan-2-yloxybenzoyl)hydrazinyl]propyl]benzenesulfonamide
CID 24539257
N'-(4-fluorobenzoyl)-4-propan-2-yloxybenzohydrazide
CID 40606275
N-[3-oxo-1-phenyl-3-[2-(4-propan-2-yloxybenzoyl)hydrazinyl]propyl]acetamide
CID 4791195
N'-(4-propan-2-yloxybenzoyl)pyridine-4-carbohydrazide
CID 959964
4-butan-2-yloxy-N'-(2-phenylacetyl)benzohydrazide
CID 17141392
N-[(2S)-4-phenylbutan-2-yl]-4-propan-2-yloxybenzamide
CID 1263174
N-[(butanoylamino)carbamothioyl]-4-propan-2-yloxybenzamide
CID 17340176

Frequently Asked Questions

What is the IUPAC name of N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide?
The IUPAC name of N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide (CID 17496431) is N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide.
What is the SMILES notation for N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide?
The canonical SMILES for N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide is CC(C)Oc1ccc(C(=O)NNC(=O)CCc2ccccc2O)cc1.
What is the InChIKey of N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide?
The InChIKey is RNBSEQOIMXKMNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-13(2)25-16-10-7-15(8-11-16)19(24)21-20-18(23)12-9-14-5-3-4-6-17(14)22/h3-8,10-11,13,22H,9,12H2,1-2H3,(H,20,23)(H,21,24).
What are the key properties of N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide?
N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide has a molecular weight of 342.40 g/mol, XLogP of 2.57, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[3-(2-hydroxyphenyl)propanoyl]-4-propan-2-yloxybenzohydrazide is sourced from PubChem (CID 17496431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).