[1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine

C16H15ClN2O2 — CID 105212912

IUPAC[1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine
SMILESNNC(COc1ccccc1)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C16H15ClN2O2/c17-12-6-7-15-11(8-12)9-16(21-15)14(19-18)10-20-13-4-2-1-3-5-13/h1-9,14,19H,10,18H2
InChIKeyMTYFNXHPAKXOJQ-UHFFFAOYSA-N
MW302.76 g/mol
LogP3.67
Rot. Bonds5

About [1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine

[1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine (PubChem CID 105212912) has the molecular formula C16H15ClN2O2 and a molecular weight of 302.76 g/mol. Its IUPAC name is [1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine
PubChem CID105212912
Molecular FormulaC16H15ClN2O2
Molecular Weight302.76 g/mol
Exact Mass302.08
IUPAC Name[1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine
SMILESNNC(COc1ccccc1)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C16H15ClN2O2/c17-12-6-7-15-11(8-12)9-16(21-15)14(19-18)10-20-13-4-2-1-3-5-13/h1-9,14,19H,10,18H2
InChIKeyMTYFNXHPAKXOJQ-UHFFFAOYSA-N
XLogP3.67
TPSA60.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[1-(5-chloro-1-benzofuran-2-yl)-2-phenylsulfanylethyl]hydrazine
CID 105228018
1-(5-chloro-1-benzofuran-2-yl)butylhydrazine
CID 105202028
[1-(7-methyl-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine
CID 105212911
[1-(5-chloro-1-benzofuran-2-yl)-2-thiophen-2-ylethyl]hydrazine
CID 105211760
1-(1-benzofuran-2-yl)-2-(3-chlorophenoxy)ethanamine
CID 105184741
methyl 4-[2-(5-chloro-1-benzofuran-2-yl)-2-hydroxyethoxy]benzoate
CID 15337970
[2-chloro-1-(5-chloro-1-benzofuran-2-yl)-2,2-difluoroethyl]hydrazine
CID 105265344
[1-(5-chloro-1-benzofuran-2-yl)-2,2-diethoxyethyl]hydrazine
CID 105246260
[2-(4-chlorophenoxy)-1-(3,4-dichlorophenyl)ethyl]hydrazine
CID 105281305
[2-(2-bicyclo[2.2.1]heptanyl)-1-(5-chloro-1-benzofuran-2-yl)ethyl]hydrazine
CID 105338486
[1-(1-benzofuran-2-yl)-2-phenylethyl]hydrazine
CID 105195415
[1-(4-methoxyphenyl)-2-phenoxyethyl]hydrazine
CID 105213017

Frequently Asked Questions

What is the IUPAC name of [1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine?
The IUPAC name of [1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine (CID 105212912) is [1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine.
What is the SMILES notation for [1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine?
The canonical SMILES for [1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine is NNC(COc1ccccc1)c1cc2cc(Cl)ccc2o1.
What is the InChIKey of [1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine?
The InChIKey is MTYFNXHPAKXOJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O2/c17-12-6-7-15-11(8-12)9-16(21-15)14(19-18)10-20-13-4-2-1-3-5-13/h1-9,14,19H,10,18H2.
What are the key properties of [1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine?
[1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine has a molecular weight of 302.76 g/mol, XLogP of 3.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-chloro-1-benzofuran-2-yl)-2-phenoxyethyl]hydrazine is sourced from PubChem (CID 105212912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).