N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide

C9H22N4 — CID 154939276

IUPACN-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide
SMILESCCCCN(C)/C(=N\NN)C(C)C
InChIInChI=1S/C9H22N4/c1-5-6-7-13(4)9(8(2)3)11-12-10/h8,12H,5-7,10H2,1-4H3/b11-9-
InChIKeyHINFCGHWKUQIKW-LUAWRHEFSA-N
MW186.30 g/mol
LogP1.15
Rot. Bonds5

About N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide

N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide (PubChem CID 154939276) has the molecular formula C9H22N4 and a molecular weight of 186.30 g/mol. Its IUPAC name is N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide.

Molecular Properties

Compound NameN-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide
PubChem CID154939276
Molecular FormulaC9H22N4
Molecular Weight186.30 g/mol
Exact Mass186.18
IUPAC NameN-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide
SMILESCCCCN(C)/C(=N\NN)C(C)C
InChIInChI=1S/C9H22N4/c1-5-6-7-13(4)9(8(2)3)11-12-10/h8,12H,5-7,10H2,1-4H3/b11-9-
InChIKeyHINFCGHWKUQIKW-LUAWRHEFSA-N
XLogP1.15
TPSA53.65 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', '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 N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide?
The IUPAC name of N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide (CID 154939276) is N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide.
What is the SMILES notation for N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide?
The canonical SMILES for N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide is CCCCN(C)/C(=N\NN)C(C)C.
What is the InChIKey of N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide?
The InChIKey is HINFCGHWKUQIKW-LUAWRHEFSA-N. The full InChI is InChI=1S/C9H22N4/c1-5-6-7-13(4)9(8(2)3)11-12-10/h8,12H,5-7,10H2,1-4H3/b11-9-.
What are the key properties of N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide?
N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide has a molecular weight of 186.30 g/mol, XLogP of 1.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N'-hydrazinyl-N,2-dimethylpropanimidamide is sourced from PubChem (CID 154939276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).