N-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride

C6H14ClN5O — CID 176535870

IUPACN-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N=CNN)N1CCOCC1
InChIInChI=1S/C6H13N5O.ClH/c7-6(9-5-10-8)11-1-3-12-4-2-11;/h5H,1-4,8H2,(H2,7,9,10);1H
InChIKeyJMPJUDXGOQAZTJ-UHFFFAOYSA-N
MW207.66 g/mol
LogP-0.83
Rot. Bonds1

About N-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride

N-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride (PubChem CID 176535870) has the molecular formula C6H14ClN5O and a molecular weight of 207.66 g/mol. Its IUPAC name is N-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride.

Molecular Properties

Compound NameN-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride
PubChem CID176535870
Molecular FormulaC6H14ClN5O
Molecular Weight207.66 g/mol
Exact Mass207.09
IUPAC NameN-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N=CNN)N1CCOCC1
InChIInChI=1S/C6H13N5O.ClH/c7-6(9-5-10-8)11-1-3-12-4-2-11;/h5H,1-4,8H2,(H2,7,9,10);1H
InChIKeyJMPJUDXGOQAZTJ-UHFFFAOYSA-N
XLogP-0.83
TPSA86.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.66
LogP ≤ 5-0.83
H-Bond Donors ≤ 53
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-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride?
The IUPAC name of N-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride (CID 176535870) is N-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride.
What is the SMILES notation for N-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride?
The canonical SMILES for N-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride is Cl.[H]/N=C(\N=CNN)N1CCOCC1.
What is the InChIKey of N-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride?
The InChIKey is JMPJUDXGOQAZTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N5O.ClH/c7-6(9-5-10-8)11-1-3-12-4-2-11;/h5H,1-4,8H2,(H2,7,9,10);1H.
What are the key properties of N-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride?
N-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride has a molecular weight of 207.66 g/mol, XLogP of -0.83, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(hydrazinylmethylidene)morpholine-4-carboximidamide;hydrochloride is sourced from PubChem (CID 176535870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).