(5E)-5-(propylhydrazinylidene)hexan-1-ol

C9H20N2O — CID 23263487

IUPAC(5E)-5-(propylhydrazinylidene)hexan-1-ol
SMILESCCCN/N=C(\C)CCCCO
InChIInChI=1S/C9H20N2O/c1-3-7-10-11-9(2)6-4-5-8-12/h10,12H,3-8H2,1-2H3/b11-9+
InChIKeyRKRHWXAPGCGXLO-PKNBQFBNSA-N
MW172.27 g/mol
LogP1.52
Rot. Bonds7

About (5E)-5-(propylhydrazinylidene)hexan-1-ol

(5E)-5-(propylhydrazinylidene)hexan-1-ol (PubChem CID 23263487) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is (5E)-5-(propylhydrazinylidene)hexan-1-ol.

Molecular Properties

Compound Name(5E)-5-(propylhydrazinylidene)hexan-1-ol
PubChem CID23263487
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name(5E)-5-(propylhydrazinylidene)hexan-1-ol
SMILESCCCN/N=C(\C)CCCCO
InChIInChI=1S/C9H20N2O/c1-3-7-10-11-9(2)6-4-5-8-12/h10,12H,3-8H2,1-2H3/b11-9+
InChIKeyRKRHWXAPGCGXLO-PKNBQFBNSA-N
XLogP1.52
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', '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 (5E)-5-(propylhydrazinylidene)hexan-1-ol?
The IUPAC name of (5E)-5-(propylhydrazinylidene)hexan-1-ol (CID 23263487) is (5E)-5-(propylhydrazinylidene)hexan-1-ol.
What is the SMILES notation for (5E)-5-(propylhydrazinylidene)hexan-1-ol?
The canonical SMILES for (5E)-5-(propylhydrazinylidene)hexan-1-ol is CCCN/N=C(\C)CCCCO.
What is the InChIKey of (5E)-5-(propylhydrazinylidene)hexan-1-ol?
The InChIKey is RKRHWXAPGCGXLO-PKNBQFBNSA-N. The full InChI is InChI=1S/C9H20N2O/c1-3-7-10-11-9(2)6-4-5-8-12/h10,12H,3-8H2,1-2H3/b11-9+.
What are the key properties of (5E)-5-(propylhydrazinylidene)hexan-1-ol?
(5E)-5-(propylhydrazinylidene)hexan-1-ol has a molecular weight of 172.27 g/mol, XLogP of 1.52, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-(propylhydrazinylidene)hexan-1-ol is sourced from PubChem (CID 23263487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).