2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide

C14H16N4O3 — CID 87015407

IUPAC2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide
SMILESO=C(COCCOc1ccccc1)NNc1ncccn1
InChIInChI=1S/C14H16N4O3/c19-13(17-18-14-15-7-4-8-16-14)11-20-9-10-21-12-5-2-1-3-6-12/h1-8H,9-11H2,(H,17,19)(H,15,16,18)
InChIKeyKVLOEGPEADFNHM-UHFFFAOYSA-N
MW288.31 g/mol
LogP1.02
Rot. Bonds8

About 2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide

2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide (PubChem CID 87015407) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is 2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide.

Molecular Properties

Compound Name2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide
PubChem CID87015407
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC Name2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide
SMILESO=C(COCCOc1ccccc1)NNc1ncccn1
InChIInChI=1S/C14H16N4O3/c19-13(17-18-14-15-7-4-8-16-14)11-20-9-10-21-12-5-2-1-3-6-12/h1-8H,9-11H2,(H,17,19)(H,15,16,18)
InChIKeyKVLOEGPEADFNHM-UHFFFAOYSA-N
XLogP1.02
TPSA85.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide
CID 47045190
N-(2-hydroxyethyl)-2-(2-phenoxyethoxy)acetamide
CID 78883192
4-[2-[2-(3-phenoxypropoxy)acetyl]hydrazinyl]benzoic acid
CID 21108841
4-methyl-4-[[2-(2-phenoxyethoxy)acetyl]amino]pentanoic acid
CID 119203692
N'-(4,6-dimethylpyrimidin-2-yl)-4-phenoxybutanehydrazide
CID 30131742
2-cyclopropyl-2-[[2-(2-phenoxyethoxy)acetyl]amino]acetic acid
CID 119213147
N-[2-(4-aminophenyl)ethyl]-2-(2-phenoxyethoxy)acetamide
CID 119547548
N-[2-(methanesulfonamido)ethyl]-2-(2-phenoxyethoxy)acetamide
CID 47034582
N-[2-(methylamino)propyl]-2-(2-phenoxyethoxy)acetamide;hydrochloride
CID 120831954
N-(4-methylsulfanylphenyl)-2-(2-phenoxyethoxy)acetamide
CID 46485144
2-[2-[4-[2-(carboxymethoxy)ethoxy]phenoxy]ethoxy]acetic acid
CID 15307009
N-(4-chloro-2,6-difluorophenyl)-2-(2-phenoxyethoxy)acetamide
CID 75443246

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide?
The IUPAC name of 2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide (CID 87015407) is 2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide.
What is the SMILES notation for 2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide?
The canonical SMILES for 2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide is O=C(COCCOc1ccccc1)NNc1ncccn1.
What is the InChIKey of 2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide?
The InChIKey is KVLOEGPEADFNHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c19-13(17-18-14-15-7-4-8-16-14)11-20-9-10-21-12-5-2-1-3-6-12/h1-8H,9-11H2,(H,17,19)(H,15,16,18).
What are the key properties of 2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide?
2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide has a molecular weight of 288.31 g/mol, XLogP of 1.02, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenoxyethoxy)-N'-pyrimidin-2-ylacetohydrazide is sourced from PubChem (CID 87015407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).