(2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine

C9H19N3 — CID 176931503

IUPAC(2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine
SMILESCCC/N=C/C(CC(C)C)=N\N
InChIInChI=1S/C9H19N3/c1-4-5-11-7-9(12-10)6-8(2)3/h7-8H,4-6,10H2,1-3H3/b11-7+,12-9-
InChIKeyFZJGIUDZPLNTDE-WSWPAOCJSA-N
MW169.27 g/mol
LogP1.83
Rot. Bonds5

About (2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine

(2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine (PubChem CID 176931503) has the molecular formula C9H19N3 and a molecular weight of 169.27 g/mol. Its IUPAC name is (2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine.

Molecular Properties

Compound Name(2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine
PubChem CID176931503
Molecular FormulaC9H19N3
Molecular Weight169.27 g/mol
Exact Mass169.16
IUPAC Name(2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine
SMILESCCC/N=C/C(CC(C)C)=N\N
InChIInChI=1S/C9H19N3/c1-4-5-11-7-9(12-10)6-8(2)3/h7-8H,4-6,10H2,1-3H3/b11-7+,12-9-
InChIKeyFZJGIUDZPLNTDE-WSWPAOCJSA-N
XLogP1.83
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 (2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine?
The IUPAC name of (2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine (CID 176931503) is (2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine.
What is the SMILES notation for (2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine?
The canonical SMILES for (2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine is CCC/N=C/C(CC(C)C)=N\N.
What is the InChIKey of (2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine?
The InChIKey is FZJGIUDZPLNTDE-WSWPAOCJSA-N. The full InChI is InChI=1S/C9H19N3/c1-4-5-11-7-9(12-10)6-8(2)3/h7-8H,4-6,10H2,1-3H3/b11-7+,12-9-.
What are the key properties of (2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine?
(2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine has a molecular weight of 169.27 g/mol, XLogP of 1.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-hydrazinylidene-4-methyl-N-propylpentan-1-imine is sourced from PubChem (CID 176931503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).