N-(6-tritio-2-pyridinyl)methanimidamide

C6H7N3 — CID 176534287

IUPACN-(6-tritio-2-pyridinyl)methanimidamide
SMILES[H]/N=C/Nc1cccc([3H])n1
InChIInChI=1S/C6H7N3/c7-5-9-6-3-1-2-4-8-6/h1-5H,(H2,7,8,9)/i4T
InChIKeyRYPWIZWYEMHJJY-IBTRZKOZSA-N
MW123.15 g/mol
LogP1.10
Rot. Bonds2

About N-(6-tritio-2-pyridinyl)methanimidamide

N-(6-tritio-2-pyridinyl)methanimidamide (PubChem CID 176534287) has the molecular formula C6H7N3 and a molecular weight of 123.15 g/mol. Its IUPAC name is N-(6-tritio-2-pyridinyl)methanimidamide.

Molecular Properties

Compound NameN-(6-tritio-2-pyridinyl)methanimidamide
PubChem CID176534287
Molecular FormulaC6H7N3
Molecular Weight123.15 g/mol
Exact Mass123.07
IUPAC NameN-(6-tritio-2-pyridinyl)methanimidamide
SMILES[H]/N=C/Nc1cccc([3H])n1
InChIInChI=1S/C6H7N3/c7-5-9-6-3-1-2-4-8-6/h1-5H,(H2,7,8,9)/i4T
InChIKeyRYPWIZWYEMHJJY-IBTRZKOZSA-N
XLogP1.10
TPSA48.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.15
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(6-tritio-2-pyridinyl)methanimidamide?
The IUPAC name of N-(6-tritio-2-pyridinyl)methanimidamide (CID 176534287) is N-(6-tritio-2-pyridinyl)methanimidamide.
What is the SMILES notation for N-(6-tritio-2-pyridinyl)methanimidamide?
The canonical SMILES for N-(6-tritio-2-pyridinyl)methanimidamide is [H]/N=C/Nc1cccc([3H])n1.
What is the InChIKey of N-(6-tritio-2-pyridinyl)methanimidamide?
The InChIKey is RYPWIZWYEMHJJY-IBTRZKOZSA-N. The full InChI is InChI=1S/C6H7N3/c7-5-9-6-3-1-2-4-8-6/h1-5H,(H2,7,8,9)/i4T.
What are the key properties of N-(6-tritio-2-pyridinyl)methanimidamide?
N-(6-tritio-2-pyridinyl)methanimidamide has a molecular weight of 123.15 g/mol, XLogP of 1.10, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-tritio-2-pyridinyl)methanimidamide is sourced from PubChem (CID 176534287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).