CID 172841024

C2H4N8Na — CID 172841024

IUPAC—
SMILES[Na].c1nn[nH]n1.c1nn[nH]n1
InChIInChI=1S/2CH2N4.Na/c2*1-2-4-5-3-1;/h2*1H,(H,2,3,4,5);
InChIKeyWUIWOLBEBIAQKB-UHFFFAOYSA-N
MW163.10 g/mol
LogP-1.98
Rot. Bonds

About CID 172841024

CID 172841024 (PubChem CID 172841024) has the molecular formula C2H4N8Na and a molecular weight of 163.10 g/mol.

Molecular Properties

Compound NameCID 172841024
PubChem CID172841024
Molecular FormulaC2H4N8Na
Molecular Weight163.10 g/mol
Exact Mass163.05
IUPAC Name—
SMILES[Na].c1nn[nH]n1.c1nn[nH]n1
InChIInChI=1S/2CH2N4.Na/c2*1-2-4-5-3-1;/h2*1H,(H,2,3,4,5);
InChIKeyWUIWOLBEBIAQKB-UHFFFAOYSA-N
XLogP-1.98
TPSA108.92 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.10
LogP ≤ 5-1.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of CID 172841024?
The IUPAC name of CID 172841024 (CID 172841024) is not available.
What is the SMILES notation for CID 172841024?
The canonical SMILES for CID 172841024 is [Na].c1nn[nH]n1.c1nn[nH]n1.
What is the InChIKey of CID 172841024?
The InChIKey is WUIWOLBEBIAQKB-UHFFFAOYSA-N. The full InChI is InChI=1S/2CH2N4.Na/c2*1-2-4-5-3-1;/h2*1H,(H,2,3,4,5);.
What are the key properties of CID 172841024?
CID 172841024 has a molecular weight of 163.10 g/mol, XLogP of -1.98, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172841024 is sourced from PubChem (CID 172841024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).