[1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine

C13H17N3O — CID 105331567

IUPAC[1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine
SMILESNNC(CCc1ccccn1)Cc1ccco1
InChIInChI=1S/C13H17N3O/c14-16-12(10-13-5-3-9-17-13)7-6-11-4-1-2-8-15-11/h1-5,8-9,12,16H,6-7,10,14H2
InChIKeyDRTGEYYIERJDLA-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.68
Rot. Bonds6

About [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine

[1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine (PubChem CID 105331567) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine
PubChem CID105331567
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name[1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine
SMILESNNC(CCc1ccccn1)Cc1ccco1
InChIInChI=1S/C13H17N3O/c14-16-12(10-13-5-3-9-17-13)7-6-11-4-1-2-8-15-11/h1-5,8-9,12,16H,6-7,10,14H2
InChIKeyDRTGEYYIERJDLA-UHFFFAOYSA-N
XLogP1.68
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.68
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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Frequently Asked Questions

What is the IUPAC name of [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine?
The IUPAC name of [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine (CID 105331567) is [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine.
What is the SMILES notation for [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine?
The canonical SMILES for [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine is NNC(CCc1ccccn1)Cc1ccco1.
What is the InChIKey of [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine?
The InChIKey is DRTGEYYIERJDLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c14-16-12(10-13-5-3-9-17-13)7-6-11-4-1-2-8-15-11/h1-5,8-9,12,16H,6-7,10,14H2.
What are the key properties of [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine?
[1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine has a molecular weight of 231.30 g/mol, XLogP of 1.68, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine is sourced from PubChem (CID 105331567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).