[2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine

C8H13N5O — CID 130521809

IUPAC[2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine
SMILESCn1cc(C(NN)C2=CCCO2)nn1
InChIInChI=1S/C8H13N5O/c1-13-5-6(11-12-13)8(10-9)7-3-2-4-14-7/h3,5,8,10H,2,4,9H2,1H3
InChIKeyDJLOHKJLACEYND-UHFFFAOYSA-N
MW195.23 g/mol
LogP-0.38
Rot. Bonds3

About [2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine

[2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine (PubChem CID 130521809) has the molecular formula C8H13N5O and a molecular weight of 195.23 g/mol. Its IUPAC name is [2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine
PubChem CID130521809
Molecular FormulaC8H13N5O
Molecular Weight195.23 g/mol
Exact Mass195.11
IUPAC Name[2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine
SMILESCn1cc(C(NN)C2=CCCO2)nn1
InChIInChI=1S/C8H13N5O/c1-13-5-6(11-12-13)8(10-9)7-3-2-4-14-7/h3,5,8,10H,2,4,9H2,1H3
InChIKeyDJLOHKJLACEYND-UHFFFAOYSA-N
XLogP-0.38
TPSA77.99 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.23
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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-(1-methyltriazol-4-yl)methyl]hydrazine?
The IUPAC name of [2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine (CID 130521809) is [2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine?
The canonical SMILES for [2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine is Cn1cc(C(NN)C2=CCCO2)nn1.
What is the InChIKey of [2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine?
The InChIKey is DJLOHKJLACEYND-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O/c1-13-5-6(11-12-13)8(10-9)7-3-2-4-14-7/h3,5,8,10H,2,4,9H2,1H3.
What are the key properties of [2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine?
[2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine has a molecular weight of 195.23 g/mol, XLogP of -0.38, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3-dihydrofuran-5-yl-(1-methyltriazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 130521809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).