N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide

C14H18N2O4 — CID 2418260

IUPACN'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide
SMILESCOc1ccc(OCC(=O)NNC(=O)C2CCC2)cc1
InChIInChI=1S/C14H18N2O4/c1-19-11-5-7-12(8-6-11)20-9-13(17)15-16-14(18)10-3-2-4-10/h5-8,10H,2-4,9H2,1H3,(H,15,17)(H,16,18)
InChIKeyWQPWVHMMPYPBEE-UHFFFAOYSA-N
MW278.31 g/mol
LogP1.02
Rot. Bonds5

About N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide

N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide (PubChem CID 2418260) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide.

Molecular Properties

Compound NameN'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide
PubChem CID2418260
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC NameN'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide
SMILESCOc1ccc(OCC(=O)NNC(=O)C2CCC2)cc1
InChIInChI=1S/C14H18N2O4/c1-19-11-5-7-12(8-6-11)20-9-13(17)15-16-14(18)10-3-2-4-10/h5-8,10H,2-4,9H2,1H3,(H,15,17)(H,16,18)
InChIKeyWQPWVHMMPYPBEE-UHFFFAOYSA-N
XLogP1.02
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-Phenoxyacetohydrazide
CID 101390
2-(2-Fluorophenoxy)propanoic acid hydrazide
CID 3865677
2-(4-Methoxyphenoxy)acetohydrazide
CID 691094
N'-[2-(2,5-dimethylphenoxy)acetyl]cyclobutanecarbohydrazide
CID 2677291
2-(4-(Trifluoromethoxy)phenoxy)acetic acid hydrazide
CID 2777305
N'-[2-(4-methoxyphenoxy)acetyl]-3-phenylpropanehydrazide
CID 3127332
N'-[2-(4-ethylphenoxy)acetyl]cyclobutanecarbohydrazide
CID 8746373
N'-[(3,4-Dimethylphenoxy)acetyl]cyclobutanecarbohydrazide
CID 25163132
N'1,N'6-bis(phenoxyacetyl)hexanedihydrazide
CID 3113773
2-(4-Fluorophenoxy)propanohydrazide
CID 5013621
2-Phenoxypropanohydrazide
CID 381468
2-(4-(Benzyloxy)phenoxy)acetohydrazide
CID 781545

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide?
The IUPAC name of N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide (CID 2418260) is N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide.
What is the SMILES notation for N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide?
The canonical SMILES for N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide is COc1ccc(OCC(=O)NNC(=O)C2CCC2)cc1.
What is the InChIKey of N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide?
The InChIKey is WQPWVHMMPYPBEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-19-11-5-7-12(8-6-11)20-9-13(17)15-16-14(18)10-3-2-4-10/h5-8,10H,2-4,9H2,1H3,(H,15,17)(H,16,18).
What are the key properties of N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide?
N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide has a molecular weight of 278.31 g/mol, XLogP of 1.02, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-methoxyphenoxy)acetyl]cyclobutanecarbohydrazide is sourced from PubChem (CID 2418260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).