N-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide

C13H28N6 — CID 176543824

IUPACN-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide
SMILES[H]/N=C(/N=C(NN)N(CCC)CCC)N1CCCCC1
InChIInChI=1S/C13H28N6/c1-3-8-19(9-4-2)13(17-15)16-12(14)18-10-6-5-7-11-18/h3-11,15H2,1-2H3,(H2,14,16,17)
InChIKeyLXCZIGPMZDSAAD-UHFFFAOYSA-N
MW268.41 g/mol
LogP1.35
Rot. Bonds4

About N-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide

N-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide (PubChem CID 176543824) has the molecular formula C13H28N6 and a molecular weight of 268.41 g/mol. Its IUPAC name is N-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide.

Molecular Properties

Compound NameN-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide
PubChem CID176543824
Molecular FormulaC13H28N6
Molecular Weight268.41 g/mol
Exact Mass268.24
IUPAC NameN-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide
SMILES[H]/N=C(/N=C(NN)N(CCC)CCC)N1CCCCC1
InChIInChI=1S/C13H28N6/c1-3-8-19(9-4-2)13(17-15)16-12(14)18-10-6-5-7-11-18/h3-11,15H2,1-2H3,(H2,14,16,17)
InChIKeyLXCZIGPMZDSAAD-UHFFFAOYSA-N
XLogP1.35
TPSA80.74 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.41
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide?
The IUPAC name of N-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide (CID 176543824) is N-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide.
What is the SMILES notation for N-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide?
The canonical SMILES for N-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide is [H]/N=C(/N=C(NN)N(CCC)CCC)N1CCCCC1.
What is the InChIKey of N-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide?
The InChIKey is LXCZIGPMZDSAAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N6/c1-3-8-19(9-4-2)13(17-15)16-12(14)18-10-6-5-7-11-18/h3-11,15H2,1-2H3,(H2,14,16,17).
What are the key properties of N-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide?
N-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide has a molecular weight of 268.41 g/mol, XLogP of 1.35, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(dipropylamino)-hydrazinylmethylidene]piperidine-1-carboximidamide is sourced from PubChem (CID 176543824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).