N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide

C14H18N2O3 — CID 51165989

IUPACN'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide
SMILESCc1ccc(OC(C)C(=O)NNC(=O)C2CC2)cc1
InChIInChI=1S/C14H18N2O3/c1-9-3-7-12(8-4-9)19-10(2)13(17)15-16-14(18)11-5-6-11/h3-4,7-8,10-11H,5-6H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyFWYPUQQJCJSYOM-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.32
Rot. Bonds4

About N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide

N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide (PubChem CID 51165989) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide.

Molecular Properties

Compound NameN'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide
PubChem CID51165989
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC NameN'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide
SMILESCc1ccc(OC(C)C(=O)NNC(=O)C2CC2)cc1
InChIInChI=1S/C14H18N2O3/c1-9-3-7-12(8-4-9)19-10(2)13(17)15-16-14(18)11-5-6-11/h3-4,7-8,10-11H,5-6H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyFWYPUQQJCJSYOM-UHFFFAOYSA-N
XLogP1.32
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.32
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-(3,4-dimethylphenoxy)propanoyl]cyclopropanecarbohydrazide
CID 17169360
1-N',4-N'-bis[2-(3,4-dimethylphenoxy)propanoyl]cyclohexane-1,4-dicarbohydrazide
CID 17169729
N'-(2-naphthalen-2-yloxypropanoyl)cyclopropanecarbohydrazide
CID 4940181
N'-[(2S)-2-(4-ethoxyphenoxy)propanoyl]cyclobutanecarbohydrazide
CID 9343434
N'-[(2R)-2-(4-ethoxyphenoxy)propanoyl]cyclobutanecarbohydrazide
CID 9343438
N'-[2-(2,5-dimethylphenoxy)propanoyl]cyclohexanecarbohydrazide
CID 4945045
(2R)-2-(4-methylphenoxy)-N'-[(2R)-2-naphthalen-2-yloxypropanoyl]propanehydrazide
CID 8757605
(2S)-2-(4-methylphenoxy)-N'-[(2R)-2-naphthalen-2-yloxypropanoyl]propanehydrazide
CID 8757604
N-[[2-(3,4-dimethylphenoxy)propanoylamino]carbamothioyl]cyclopropanecarboxamide
CID 17169509
N-(4-methylcyclohexyl)-2-(4-methylphenoxy)propanamide
CID 42889091
(2R)-N-[(2S)-3-methylbutan-2-yl]-2-(4-methylphenoxy)propanamide
CID 94665564
N-[4-[[[(2R)-2-(4-propan-2-ylphenoxy)propanoyl]amino]carbamoyl]phenyl]cyclopropanecarboxamide
CID 9241022

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide?
The IUPAC name of N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide (CID 51165989) is N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide.
What is the SMILES notation for N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide?
The canonical SMILES for N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide is Cc1ccc(OC(C)C(=O)NNC(=O)C2CC2)cc1.
What is the InChIKey of N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide?
The InChIKey is FWYPUQQJCJSYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-9-3-7-12(8-4-9)19-10(2)13(17)15-16-14(18)11-5-6-11/h3-4,7-8,10-11H,5-6H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide?
N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide has a molecular weight of 262.31 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-methylphenoxy)propanoyl]cyclopropanecarbohydrazide is sourced from PubChem (CID 51165989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).