[2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine

C9H11IN2OS — CID 102654366

IUPAC[2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine
SMILESNNC(C1=CCCO1)c1csc(I)c1
InChIInChI=1S/C9H11IN2OS/c10-8-4-6(5-14-8)9(12-11)7-2-1-3-13-7/h2,4-5,9,12H,1,3,11H2
InChIKeyBYLQGVPHOHNSET-UHFFFAOYSA-N
MW322.17 g/mol
LogP2.16
Rot. Bonds3

About [2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine

[2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine (PubChem CID 102654366) has the molecular formula C9H11IN2OS and a molecular weight of 322.17 g/mol. Its IUPAC name is [2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine
PubChem CID102654366
Molecular FormulaC9H11IN2OS
Molecular Weight322.17 g/mol
Exact Mass321.96
IUPAC Name[2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine
SMILESNNC(C1=CCCO1)c1csc(I)c1
InChIInChI=1S/C9H11IN2OS/c10-8-4-6(5-14-8)9(12-11)7-2-1-3-13-7/h2,4-5,9,12H,1,3,11H2
InChIKeyBYLQGVPHOHNSET-UHFFFAOYSA-N
XLogP2.16
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.17
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine?
The IUPAC name of [2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine (CID 102654366) is [2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine.
What is the SMILES notation for [2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine?
The canonical SMILES for [2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine is NNC(C1=CCCO1)c1csc(I)c1.
What is the InChIKey of [2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine?
The InChIKey is BYLQGVPHOHNSET-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11IN2OS/c10-8-4-6(5-14-8)9(12-11)7-2-1-3-13-7/h2,4-5,9,12H,1,3,11H2.
What are the key properties of [2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine?
[2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine has a molecular weight of 322.17 g/mol, XLogP of 2.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine is sourced from PubChem (CID 102654366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).