[3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine

C11H22N4O — CID 105267061

IUPAC[3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine
SMILESCCCn1ccnc1C(CC(C)OC)NN
InChIInChI=1S/C11H22N4O/c1-4-6-15-7-5-13-11(15)10(14-12)8-9(2)16-3/h5,7,9-10,14H,4,6,8,12H2,1-3H3
InChIKeyVBIKQMPZOYCQNI-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.22
Rot. Bonds7

About [3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine

[3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine (PubChem CID 105267061) has the molecular formula C11H22N4O and a molecular weight of 226.32 g/mol. Its IUPAC name is [3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine.

Molecular Properties

Compound Name[3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine
PubChem CID105267061
Molecular FormulaC11H22N4O
Molecular Weight226.32 g/mol
Exact Mass226.18
IUPAC Name[3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine
SMILESCCCn1ccnc1C(CC(C)OC)NN
InChIInChI=1S/C11H22N4O/c1-4-6-15-7-5-13-11(15)10(14-12)8-9(2)16-3/h5,7,9-10,14H,4,6,8,12H2,1-3H3
InChIKeyVBIKQMPZOYCQNI-UHFFFAOYSA-N
XLogP1.22
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 [3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine?
The IUPAC name of [3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine (CID 105267061) is [3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine.
What is the SMILES notation for [3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine?
The canonical SMILES for [3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine is CCCn1ccnc1C(CC(C)OC)NN.
What is the InChIKey of [3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine?
The InChIKey is VBIKQMPZOYCQNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O/c1-4-6-15-7-5-13-11(15)10(14-12)8-9(2)16-3/h5,7,9-10,14H,4,6,8,12H2,1-3H3.
What are the key properties of [3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine?
[3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine has a molecular weight of 226.32 g/mol, XLogP of 1.22, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methoxy-1-(1-propylimidazol-2-yl)butyl]hydrazine is sourced from PubChem (CID 105267061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).