N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate

C7H7N4Se- — CID 54577616

IUPACN'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate
SMILESN/C([Se-])=N/N=C/c1ccccn1
InChIInChI=1S/C7H8N4Se/c8-7(12)11-10-5-6-3-1-2-4-9-6/h1-5H,(H3,8,11,12)/p-1/b10-5+
InChIKeyNSXUGZUSQZMLKS-BJMVGYQFSA-M
MW226.12 g/mol
LogP-0.10
Rot. Bonds2

About N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate

N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate (PubChem CID 54577616) has the molecular formula C7H7N4Se- and a molecular weight of 226.12 g/mol. Its IUPAC name is N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate.

Molecular Properties

Compound NameN'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate
PubChem CID54577616
Molecular FormulaC7H7N4Se-
Molecular Weight226.12 g/mol
Exact Mass226.98
IUPAC NameN'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate
SMILESN/C([Se-])=N/N=C/c1ccccn1
InChIInChI=1S/C7H8N4Se/c8-7(12)11-10-5-6-3-1-2-4-9-6/h1-5H,(H3,8,11,12)/p-1/b10-5+
InChIKeyNSXUGZUSQZMLKS-BJMVGYQFSA-M
XLogP-0.10
TPSA63.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.12
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', '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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Related Compounds

1,2-bis(pyridin-2-ylmethylideneamino)guanidine
CID 53440400
2-N-[(E)-pyridin-2-ylmethylideneamino]-3-N-[(Z)-[(3Z)-3-[(Z)-[(3E)-3-[(E)-pyridin-2-ylmethylidenehydrazinylidene]butan-2-ylidene]hydrazinylidene]butan-2-ylidene]amino]butane-2,3-diimine
CID 11979937
bis((E)-methylsulfanyl-[(E)-pyridin-2-ylmethylidenehydrazinylidene]-sulfidomethane);nickel(2+)
CID 42616478
[(Z)-pyridin-2-ylmethylideneamino] carbamate
CID 5381364
[(Z)-pyridin-2-ylmethylideneamino]thiourea
CID 5354113
chloroplatinum(1+);(NE,1Z)-N-(pyridin-2-ylmethylidene)azepane-1-carbohydrazonothioate
CID 42597313
2-(2-pyridin-2-ylethenyl)pyridine
CID 161029843
N-tert-butyl-1-pyridin-2-ylmethanimine
CID 11389570
CID 50936105
CID 50936105
[amino(sulfoniumylidene)methyl]-[(E)-pyridin-2-ylmethylideneamino]azanide;iron;sulfuric acid
CID 16678006
tetrakis(benzene-1,2-diol);bis(2-[(E)-2-pyridin-2-ylethenyl]pyridine)
CID 139185658
1,3-bis[(E)-pyridin-2-ylmethylideneamino]thiourea;bis(cadmium(2+))
CID 10436322

Frequently Asked Questions

What is the IUPAC name of N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate?
The IUPAC name of N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate (CID 54577616) is N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate.
What is the SMILES notation for N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate?
The canonical SMILES for N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate is N/C([Se-])=N/N=C/c1ccccn1.
What is the InChIKey of N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate?
The InChIKey is NSXUGZUSQZMLKS-BJMVGYQFSA-M. The full InChI is InChI=1S/C7H8N4Se/c8-7(12)11-10-5-6-3-1-2-4-9-6/h1-5H,(H3,8,11,12)/p-1/b10-5+.
What are the key properties of N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate?
N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate has a molecular weight of 226.12 g/mol, XLogP of -0.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate is sourced from PubChem (CID 54577616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).